2024-03-01T17:41:13,874 Created temporary directory: /tmp/pip-build-tracker-bt64strz 2024-03-01T17:41:13,875 Initialized build tracking at /tmp/pip-build-tracker-bt64strz 2024-03-01T17:41:13,876 Created build tracker: /tmp/pip-build-tracker-bt64strz 2024-03-01T17:41:13,876 Entered build tracker: /tmp/pip-build-tracker-bt64strz 2024-03-01T17:41:13,877 Created temporary directory: /tmp/pip-wheel-0ptxbfit 2024-03-01T17:41:13,882 Created temporary directory: /tmp/pip-ephem-wheel-cache-3w8b6k6f 2024-03-01T17:41:13,910 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-03-01T17:41:13,914 2 location(s) to search for versions of moleculekit: 2024-03-01T17:41:13,914 * https://pypi.org/simple/moleculekit/ 2024-03-01T17:41:13,914 * https://www.piwheels.org/simple/moleculekit/ 2024-03-01T17:41:13,914 Fetching project page and analyzing links: https://pypi.org/simple/moleculekit/ 2024-03-01T17:41:13,915 Getting page https://pypi.org/simple/moleculekit/ 2024-03-01T17:41:13,916 Found index url https://pypi.org/simple/ 2024-03-01T17:41:13,976 Fetched page https://pypi.org/simple/moleculekit/ as application/vnd.pypi.simple.v1+json 2024-03-01T17:41:14,019 Skipping link: No binaries permitted for moleculekit: https://files.pythonhosted.org/packages/91/e6/25b6853357dfef8a4026325e420d8213d34c17c078a2f13b60cbb6213ea3/moleculekit-0.1.4-py3-none-any.whl (from https://pypi.org/simple/moleculekit/) 2024-03-01T17:41:14,019 Found link https://files.pythonhosted.org/packages/13/0f/a200e8e7632d3a521cfc7c15fa4d0270802efce40f98ac5a5cae58385b7e/moleculekit-0.1.4.tar.gz (from https://pypi.org/simple/moleculekit/), version: 0.1.4 2024-03-01T17:41:14,019 Skipping link: No binaries permitted for moleculekit: https://files.pythonhosted.org/packages/9f/a5/eac32fcb2e9ff0d30298aa4cec8e152c95d675c4dd1a1a5d7676986d4d75/moleculekit-0.1.5-py3-none-any.whl (from https://pypi.org/simple/moleculekit/) 2024-03-01T17:41:14,020 Found link 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links for project 'moleculekit': discarding no candidates 2024-03-01T17:41:15,619 Collecting moleculekit==1.8.26 2024-03-01T17:41:15,621 Created temporary directory: /tmp/pip-unpack-ic9ijpz8 2024-03-01T17:41:15,675 Downloading moleculekit-1.8.26.tar.gz (6.8 MB) 2024-03-01T17:41:18,226 Added moleculekit==1.8.26 from https://files.pythonhosted.org/packages/f2/d0/2c92a559a74562405f0628bc7880908412790a87c494c9b73e3962c7baa9/moleculekit-1.8.26.tar.gz to build tracker '/tmp/pip-build-tracker-bt64strz' 2024-03-01T17:41:18,235 Created temporary directory: /tmp/pip-build-env-3hj_m8wa 2024-03-01T17:41:18,245 Installing build dependencies: started 2024-03-01T17:41:18,246 Running command pip subprocess to install build dependencies 2024-03-01T17:41:19,432 Using pip 23.3 from /home/piwheels/.local/lib/python3.9/site-packages/pip (python 3.9) 2024-03-01T17:41:20,015 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-03-01T17:41:21,684 Collecting setuptools 2024-03-01T17:41:21,973 Using cached https://www.piwheels.org/simple/setuptools/setuptools-69.1.1-py3-none-any.whl (819 kB) 2024-03-01T17:41:23,018 Collecting numpy>=1.18.5 2024-03-01T17:41:23,107 Using cached https://www.piwheels.org/simple/numpy/numpy-1.26.4-cp39-cp39-linux_armv7l.whl (5.6 MB) 2024-03-01T17:41:25,054 Collecting Cython>=0.29.21 2024-03-01T17:41:25,055 Obtaining dependency information for Cython>=0.29.21 from https://files.pythonhosted.org/packages/e3/7f/f584f5d15323feb897d42ef0e9d910649e2150d7a30cf7e7a8cc1d236e6f/Cython-3.0.8-py2.py3-none-any.whl.metadata 2024-03-01T17:41:25,062 Using cached Cython-3.0.8-py2.py3-none-any.whl.metadata (3.2 kB) 2024-03-01T17:41:25,142 Collecting toml 2024-03-01T17:41:25,171 Using cached https://www.piwheels.org/simple/toml/toml-0.10.2-py2.py3-none-any.whl (16 kB) 2024-03-01T17:41:26,222 Collecting versioneer==0.28 (from versioneer[toml]==0.28) 2024-03-01T17:41:26,313 WARNING: Retrying (Retry(total=4, connect=None, read=None, redirect=None, status=None)) after connection broken by 'ProtocolError('Connection aborted.', RemoteDisconnected('Remote end closed connection without response'))': /simple/versioneer/versioneer-0.28-py3-none-any.whl 2024-03-01T17:41:26,746 Using cached https://www.piwheels.org/simple/versioneer/versioneer-0.28-py3-none-any.whl (45 kB) 2024-03-01T17:41:26,896 Collecting tomli (from versioneer[toml]==0.28) 2024-03-01T17:41:27,072 WARNING: Retrying (Retry(total=4, connect=None, read=None, redirect=None, status=None)) after connection broken by 'ProtocolError('Connection aborted.', RemoteDisconnected('Remote end closed connection without response'))': /simple/tomli/tomli-2.0.1-py3-none-any.whl 2024-03-01T17:41:27,516 Using cached https://www.piwheels.org/simple/tomli/tomli-2.0.1-py3-none-any.whl (12 kB) 2024-03-01T17:41:27,777 Using cached Cython-3.0.8-py2.py3-none-any.whl (1.2 MB) 2024-03-01T17:41:30,599 Installing collected packages: versioneer, tomli, toml, setuptools, numpy, Cython 2024-03-01T17:41:30,688 Creating /tmp/pip-build-env-3hj_m8wa/overlay/bin 2024-03-01T17:41:30,690 changing mode of /tmp/pip-build-env-3hj_m8wa/overlay/bin/versioneer to 755 2024-03-01T17:41:41,343 changing mode of /tmp/pip-build-env-3hj_m8wa/overlay/bin/f2py to 755 2024-03-01T17:41:44,173 changing mode of /tmp/pip-build-env-3hj_m8wa/overlay/bin/cygdb to 755 2024-03-01T17:41:44,175 changing mode of /tmp/pip-build-env-3hj_m8wa/overlay/bin/cython to 755 2024-03-01T17:41:44,177 changing mode of /tmp/pip-build-env-3hj_m8wa/overlay/bin/cythonize to 755 2024-03-01T17:41:44,205 ERROR: pip's dependency resolver does not currently take into account all the packages that are installed. This behaviour is the source of the following dependency conflicts. 2024-03-01T17:41:44,205 scipy 1.8.1 requires numpy<1.25.0,>=1.17.3, but you have numpy 1.26.4 which is incompatible. 2024-03-01T17:41:44,206 Successfully installed Cython-3.0.8 numpy-1.26.4 setuptools-69.1.1 toml-0.10.2 tomli-2.0.1 versioneer-0.28 2024-03-01T17:41:44,389 WARNING: There was an error checking the latest version of pip. 2024-03-01T17:41:44,852 Installing build dependencies: finished with status 'done' 2024-03-01T17:41:44,857 Getting requirements to build wheel: started 2024-03-01T17:41:44,858 Running command Getting requirements to build wheel 2024-03-01T17:43:02,282 warning: moleculekit/wrapping/wrapping.pyx:47:4: Unreachable code 2024-03-01T17:43:21,061 Compiling moleculekit/interactions/hbonds/hbonds.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,061 Compiling moleculekit/interactions/pipi/pipi.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,061 Compiling moleculekit/interactions/cationpi/cationpi.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,062 Compiling moleculekit/interactions/sigmahole/sigmahole.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,062 Compiling moleculekit/wrapping/wrapping.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,062 Compiling moleculekit/bondguesser_utils/bondguesser_utils.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,062 Compiling moleculekit/atomselect_utils/atomselect_utils.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,062 Compiling moleculekit/distance_utils/distance_utils.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,062 Compiling moleculekit/occupancy_utils/occupancy_utils.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,062 Compiling moleculekit/cython_utils/cython_utils.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,062 Compiling moleculekit/fileformats/xtc/xtc.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-03-01T17:43:21,063 Compiling moleculekit/fileformats/xtc/trr.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-03-01T17:43:21,063 Compiling moleculekit/fileformats/dcd/dcd.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-03-01T17:43:21,063 Compiling moleculekit/fileformats/binpos/binpos.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-03-01T17:43:21,063 Compiling moleculekit/tmalign/tmalign_util.pyx because it depends on /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-03-01T17:43:21,063 [ 1/15] Cythonizing moleculekit/atomselect_utils/atomselect_utils.pyx 2024-03-01T17:43:21,063 [ 2/15] Cythonizing moleculekit/bondguesser_utils/bondguesser_utils.pyx 2024-03-01T17:43:21,063 [ 3/15] Cythonizing moleculekit/cython_utils/cython_utils.pyx 2024-03-01T17:43:21,063 [ 4/15] Cythonizing moleculekit/distance_utils/distance_utils.pyx 2024-03-01T17:43:21,063 [ 5/15] Cythonizing moleculekit/fileformats/dcd/dcd.pyx 2024-03-01T17:43:21,064 [ 6/15] Cythonizing moleculekit/interactions/cationpi/cationpi.pyx 2024-03-01T17:43:21,064 [ 7/15] Cythonizing moleculekit/interactions/hbonds/hbonds.pyx 2024-03-01T17:43:21,064 [ 8/15] Cythonizing moleculekit/interactions/pipi/pipi.pyx 2024-03-01T17:43:21,064 [ 9/15] Cythonizing moleculekit/interactions/sigmahole/sigmahole.pyx 2024-03-01T17:43:21,064 [10/15] Cythonizing moleculekit/occupancy_utils/occupancy_utils.pyx 2024-03-01T17:43:21,064 [11/15] Cythonizing moleculekit/tmalign/tmalign_util.pyx 2024-03-01T17:43:21,064 [12/15] Cythonizing moleculekit/wrapping/wrapping.pyx 2024-03-01T17:43:21,064 [13/15] Cythonizing moleculekit/fileformats/binpos/binpos.pyx 2024-03-01T17:43:21,064 [14/15] Cythonizing moleculekit/fileformats/xtc/trr.pyx 2024-03-01T17:43:21,065 [15/15] Cythonizing moleculekit/fileformats/xtc/xtc.pyx 2024-03-01T17:43:21,375 running egg_info 2024-03-01T17:43:21,382 writing moleculekit.egg-info/PKG-INFO 2024-03-01T17:43:21,386 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-03-01T17:43:21,388 writing requirements to moleculekit.egg-info/requires.txt 2024-03-01T17:43:21,390 writing top-level names to moleculekit.egg-info/top_level.txt 2024-03-01T17:43:21,425 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,425 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,426 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,426 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,427 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,427 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,427 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,428 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,428 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,429 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,429 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,429 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,430 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,430 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,430 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,431 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,431 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,432 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,432 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,432 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,433 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,433 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,434 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,434 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,435 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,435 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,435 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,435 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,436 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,436 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,436 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,436 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,436 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,436 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,437 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,437 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,437 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,437 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,437 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,437 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,437 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,437 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,438 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,438 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,438 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,438 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,438 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,438 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,438 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,439 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,439 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,439 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,439 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,439 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,439 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,440 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,440 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,440 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,440 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,440 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,442 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,442 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,442 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,442 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,442 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,443 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:21,443 dependency 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https://www.piwheels.org/simple/wheel/wheel-0.42.0-py3-none-any.whl (65 kB) 2024-03-01T17:43:27,652 Installing collected packages: wheel 2024-03-01T17:43:27,893 Creating /tmp/pip-build-env-3hj_m8wa/normal/bin 2024-03-01T17:43:27,895 changing mode of /tmp/pip-build-env-3hj_m8wa/normal/bin/wheel to 755 2024-03-01T17:43:27,909 Successfully installed wheel-0.42.0 2024-03-01T17:43:28,088 WARNING: There was an error checking the latest version of pip. 2024-03-01T17:43:28,317 Installing backend dependencies: finished with status 'done' 2024-03-01T17:43:28,320 Created temporary directory: /tmp/pip-modern-metadata-xhkt_jbx 2024-03-01T17:43:28,323 Preparing metadata (pyproject.toml): started 2024-03-01T17:43:28,324 Running command Preparing metadata (pyproject.toml) 2024-03-01T17:43:31,068 running dist_info 2024-03-01T17:43:31,070 creating /tmp/pip-modern-metadata-xhkt_jbx/moleculekit.egg-info 2024-03-01T17:43:31,079 writing /tmp/pip-modern-metadata-xhkt_jbx/moleculekit.egg-info/PKG-INFO 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manifest: the path must be relative 2024-03-01T17:43:31,130 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:31,131 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:31,131 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:31,131 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:31,131 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:31,139 reading manifest file '/tmp/pip-modern-metadata-xhkt_jbx/moleculekit.egg-info/SOURCES.txt' 2024-03-01T17:43:31,141 reading manifest template 'MANIFEST.in' 2024-03-01T17:43:31,421 no previously-included directories found matching 'moleculekit/test-data' 2024-03-01T17:43:31,421 no previously-included directories found matching 'moleculekit/tests' 2024-03-01T17:43:31,422 no previously-included directories found matching 'package' 2024-03-01T17:43:31,422 adding license file 'LICENSE' 2024-03-01T17:43:31,436 writing manifest file '/tmp/pip-modern-metadata-xhkt_jbx/moleculekit.egg-info/SOURCES.txt' 2024-03-01T17:43:31,445 creating '/tmp/pip-modern-metadata-xhkt_jbx/moleculekit-1.8.26.dist-info' 2024-03-01T17:43:31,644 Preparing metadata (pyproject.toml): finished with status 'done' 2024-03-01T17:43:31,651 Source in /tmp/pip-wheel-0ptxbfit/moleculekit_2d90c445484d41c4ae2c2cdbcca6aa0d has version 1.8.26, which satisfies requirement moleculekit==1.8.26 from https://files.pythonhosted.org/packages/f2/d0/2c92a559a74562405f0628bc7880908412790a87c494c9b73e3962c7baa9/moleculekit-1.8.26.tar.gz 2024-03-01T17:43:31,652 Removed moleculekit==1.8.26 from https://files.pythonhosted.org/packages/f2/d0/2c92a559a74562405f0628bc7880908412790a87c494c9b73e3962c7baa9/moleculekit-1.8.26.tar.gz from build tracker '/tmp/pip-build-tracker-bt64strz' 2024-03-01T17:43:31,658 Created temporary directory: /tmp/pip-unpack-042vj0o_ 2024-03-01T17:43:31,658 Created temporary directory: /tmp/pip-unpack-5kg6amo2 2024-03-01T17:43:31,667 Building wheels for collected packages: moleculekit 2024-03-01T17:43:31,671 Created temporary directory: /tmp/pip-wheel-tnquqshb 2024-03-01T17:43:31,671 Destination directory: /tmp/pip-wheel-tnquqshb 2024-03-01T17:43:31,673 Building wheel for moleculekit (pyproject.toml): started 2024-03-01T17:43:31,674 Running command Building wheel for moleculekit (pyproject.toml) 2024-03-01T17:43:34,456 running bdist_wheel 2024-03-01T17:43:34,476 running build 2024-03-01T17:43:34,476 running build_py 2024-03-01T17:43:34,484 creating build 2024-03-01T17:43:34,484 creating build/lib.linux-armv7l-cpython-39 2024-03-01T17:43:34,485 creating build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,486 copying moleculekit/home.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,489 copying moleculekit/opm.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,491 copying moleculekit/align.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,493 copying moleculekit/pymolgraphics.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,495 copying moleculekit/vmdgraphics.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,497 copying moleculekit/writers.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,502 copying moleculekit/readers.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,508 copying moleculekit/molecule.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,515 copying moleculekit/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,518 copying moleculekit/version.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,520 copying moleculekit/distance.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,521 copying moleculekit/bondguesser.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,524 copying moleculekit/_version.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,525 copying moleculekit/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,527 copying moleculekit/config.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,528 copying moleculekit/vmdviewer.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,531 copying moleculekit/rcsb.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,532 copying moleculekit/periodictable.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,535 copying moleculekit/rdkitintegration.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,536 copying moleculekit/viewer.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,538 copying moleculekit/dihedral.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:34,541 creating build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,542 copying moleculekit/tools/autosegment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,545 copying moleculekit/tools/sequencestructuralalignment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,547 copying moleculekit/tools/preparation_customres.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,549 copying moleculekit/tools/docking.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,551 copying moleculekit/tools/atomtyper.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,554 copying moleculekit/tools/graphalignment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,556 copying moleculekit/tools/detect.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,559 copying moleculekit/tools/hhblitsprofile.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,560 copying moleculekit/tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,562 copying moleculekit/tools/voxeldescriptors.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,565 copying moleculekit/tools/moleculechecks.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,568 copying moleculekit/tools/crystalpacking.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,570 copying moleculekit/tools/preparation.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,573 copying moleculekit/tools/modelling.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-03-01T17:43:34,576 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-03-01T17:43:34,577 copying moleculekit/interactions/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-03-01T17:43:34,578 copying moleculekit/interactions/interactions.py -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-03-01T17:43:34,582 creating build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-03-01T17:43:34,583 copying moleculekit/atomselect/atomselect.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-03-01T17:43:34,585 copying moleculekit/atomselect/languageparser.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-03-01T17:43:34,588 copying moleculekit/atomselect/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-03-01T17:43:34,589 copying moleculekit/atomselect/analyze.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-03-01T17:43:34,591 creating build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-03-01T17:43:34,592 copying moleculekit/ply/yacc.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-03-01T17:43:34,597 copying moleculekit/ply/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-03-01T17:43:34,599 copying moleculekit/ply/lex.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-03-01T17:43:34,602 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-03-01T17:43:34,603 copying moleculekit/fileformats/utils.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-03-01T17:43:34,606 copying moleculekit/fileformats/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-03-01T17:43:34,607 copying moleculekit/fileformats/netcdf.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-03-01T17:43:34,611 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx 2024-03-01T17:43:34,612 copying moleculekit/pdbx/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx 2024-03-01T17:43:34,614 creating build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-03-01T17:43:34,615 copying moleculekit/smallmol/test_smallmollib.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-03-01T17:43:34,618 copying moleculekit/smallmol/smallmol.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-03-01T17:43:34,621 copying moleculekit/smallmol/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-03-01T17:43:34,623 copying moleculekit/smallmol/test_smallmol.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-03-01T17:43:34,626 copying moleculekit/smallmol/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-03-01T17:43:34,627 copying moleculekit/smallmol/smallmollib.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-03-01T17:43:34,631 creating build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,632 copying moleculekit/projections/metricdistance.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,635 copying moleculekit/projections/metricshell.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,637 copying moleculekit/projections/metricfluctuation.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,640 copying moleculekit/projections/metricsphericalcoordinate.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,642 copying moleculekit/projections/metricrmsd.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,644 copying moleculekit/projections/metricdihedral.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,646 copying moleculekit/projections/metrictmscore.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,648 copying moleculekit/projections/metricsasa.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,651 copying moleculekit/projections/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,653 copying moleculekit/projections/metricgyration.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,655 copying moleculekit/projections/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,657 copying moleculekit/projections/metricsecondarystructure.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,659 copying moleculekit/projections/projection.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,661 copying moleculekit/projections/metricplumed2.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,663 copying moleculekit/projections/metriccoordinate.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-03-01T17:43:34,666 creating build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-03-01T17:43:34,667 copying moleculekit/tools/obabel_tools/obabel_cli.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-03-01T17:43:34,669 copying moleculekit/tools/obabel_tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-03-01T17:43:34,672 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-03-01T17:43:34,673 copying moleculekit/pdbx/tests/PdbxWriterTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-03-01T17:43:34,676 copying moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-03-01T17:43:34,678 copying moleculekit/pdbx/tests/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-03-01T17:43:34,680 copying moleculekit/pdbx/tests/PdbxReaderTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-03-01T17:43:34,683 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-03-01T17:43:34,684 copying moleculekit/pdbx/reader/PdbxParser.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-03-01T17:43:34,687 copying moleculekit/pdbx/reader/PdbxContainers.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-03-01T17:43:34,691 copying moleculekit/pdbx/reader/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-03-01T17:43:34,692 copying moleculekit/pdbx/reader/PdbxReader.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-03-01T17:43:34,696 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-03-01T17:43:34,697 copying moleculekit/pdbx/writer/PdbxWriter.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-03-01T17:43:34,699 copying moleculekit/pdbx/writer/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-03-01T17:43:34,702 creating build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-03-01T17:43:34,703 copying moleculekit/smallmol/tools/test_tools.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-03-01T17:43:34,705 copying moleculekit/smallmol/tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-03-01T17:43:34,707 copying moleculekit/smallmol/tools/clustering.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-03-01T17:43:34,710 copying moleculekit/smallmol/tools/restrainedembed.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-03-01T17:43:34,713 running egg_info 2024-03-01T17:43:34,720 writing moleculekit.egg-info/PKG-INFO 2024-03-01T17:43:34,723 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-03-01T17:43:34,725 writing requirements to moleculekit.egg-info/requires.txt 2024-03-01T17:43:34,726 writing top-level names to moleculekit.egg-info/top_level.txt 2024-03-01T17:43:34,745 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,746 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,746 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,747 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,747 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,747 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,748 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,748 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,748 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,749 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,749 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,749 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,750 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,750 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,750 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,751 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,751 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,751 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,752 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,752 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,752 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,753 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,753 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,753 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,754 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,754 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,754 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,755 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,755 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,755 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,756 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,756 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,756 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,757 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,757 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,757 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,758 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,758 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,758 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,759 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,759 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,759 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,760 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,760 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,760 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,761 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,761 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,761 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,762 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,762 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,762 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,763 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,763 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,763 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,764 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,764 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,765 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,765 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,765 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,766 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,768 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,768 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,768 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,769 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,769 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,770 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,770 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,771 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,771 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,771 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,772 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,773 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,773 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,773 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,774 dependency /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-03-01T17:43:34,780 reading manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-03-01T17:43:34,790 reading manifest template 'MANIFEST.in' 2024-03-01T17:43:35,057 no previously-included directories found matching 'moleculekit/test-data' 2024-03-01T17:43:35,059 no previously-included directories found matching 'moleculekit/tests' 2024-03-01T17:43:35,060 no previously-included directories found matching 'package' 2024-03-01T17:43:35,061 adding license file 'LICENSE' 2024-03-01T17:43:35,080 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-03-01T17:43:35,093 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.atomselect_utils' is absent from the `packages` configuration. 2024-03-01T17:43:35,093 !! 2024-03-01T17:43:35,094 ******************************************************************************** 2024-03-01T17:43:35,094 ############################ 2024-03-01T17:43:35,094 # Package would be ignored # 2024-03-01T17:43:35,094 ############################ 2024-03-01T17:43:35,094 Python recognizes 'moleculekit.atomselect_utils' as an importable package[^1], 2024-03-01T17:43:35,094 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,094 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,095 package, please make sure that 'moleculekit.atomselect_utils' is explicitly added 2024-03-01T17:43:35,095 to the `packages` configuration field. 2024-03-01T17:43:35,095 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,095 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,095 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,095 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,096 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,096 If you don't want 'moleculekit.atomselect_utils' to be distributed and are 2024-03-01T17:43:35,096 already explicitly excluding 'moleculekit.atomselect_utils' via 2024-03-01T17:43:35,096 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,096 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,096 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,097 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,097 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,097 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,097 even if it does not contain any `.py` files. 2024-03-01T17:43:35,097 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,098 directory, all directories are treated like packages. 2024-03-01T17:43:35,098 ******************************************************************************** 2024-03-01T17:43:35,098 !! 2024-03-01T17:43:35,098 check.warn(importable) 2024-03-01T17:43:35,098 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.bondguesser_utils' is absent from the `packages` configuration. 2024-03-01T17:43:35,098 !! 2024-03-01T17:43:35,099 ******************************************************************************** 2024-03-01T17:43:35,099 ############################ 2024-03-01T17:43:35,099 # Package would be ignored # 2024-03-01T17:43:35,099 ############################ 2024-03-01T17:43:35,099 Python recognizes 'moleculekit.bondguesser_utils' as an importable package[^1], 2024-03-01T17:43:35,099 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,099 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,100 package, please make sure that 'moleculekit.bondguesser_utils' is explicitly added 2024-03-01T17:43:35,100 to the `packages` configuration field. 2024-03-01T17:43:35,100 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,100 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,100 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,100 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,101 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,101 If you don't want 'moleculekit.bondguesser_utils' to be distributed and are 2024-03-01T17:43:35,101 already explicitly excluding 'moleculekit.bondguesser_utils' via 2024-03-01T17:43:35,101 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,101 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,101 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,101 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,102 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,102 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,102 even if it does not contain any `.py` files. 2024-03-01T17:43:35,102 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,102 directory, all directories are treated like packages. 2024-03-01T17:43:35,102 ******************************************************************************** 2024-03-01T17:43:35,103 !! 2024-03-01T17:43:35,103 check.warn(importable) 2024-03-01T17:43:35,103 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.cython_utils' is absent from the `packages` configuration. 2024-03-01T17:43:35,103 !! 2024-03-01T17:43:35,103 ******************************************************************************** 2024-03-01T17:43:35,103 ############################ 2024-03-01T17:43:35,104 # Package would be ignored # 2024-03-01T17:43:35,104 ############################ 2024-03-01T17:43:35,104 Python recognizes 'moleculekit.cython_utils' as an importable package[^1], 2024-03-01T17:43:35,104 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,104 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,104 package, please make sure that 'moleculekit.cython_utils' is explicitly added 2024-03-01T17:43:35,104 to the `packages` configuration field. 2024-03-01T17:43:35,105 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,105 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,105 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,105 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,105 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,105 If you don't want 'moleculekit.cython_utils' to be distributed and are 2024-03-01T17:43:35,106 already explicitly excluding 'moleculekit.cython_utils' via 2024-03-01T17:43:35,106 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,106 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,106 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,106 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,106 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,107 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,107 even if it does not contain any `.py` files. 2024-03-01T17:43:35,107 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,107 directory, all directories are treated like packages. 2024-03-01T17:43:35,107 ******************************************************************************** 2024-03-01T17:43:35,107 !! 2024-03-01T17:43:35,107 check.warn(importable) 2024-03-01T17:43:35,107 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.distance_utils' is absent from the `packages` configuration. 2024-03-01T17:43:35,108 !! 2024-03-01T17:43:35,108 ******************************************************************************** 2024-03-01T17:43:35,108 ############################ 2024-03-01T17:43:35,108 # Package would be ignored # 2024-03-01T17:43:35,108 ############################ 2024-03-01T17:43:35,108 Python recognizes 'moleculekit.distance_utils' as an importable package[^1], 2024-03-01T17:43:35,108 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,108 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,109 package, please make sure that 'moleculekit.distance_utils' is explicitly added 2024-03-01T17:43:35,109 to the `packages` configuration field. 2024-03-01T17:43:35,109 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,109 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,109 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,109 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,110 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,110 If you don't want 'moleculekit.distance_utils' to be distributed and are 2024-03-01T17:43:35,110 already explicitly excluding 'moleculekit.distance_utils' via 2024-03-01T17:43:35,110 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,110 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,110 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,110 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,111 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,111 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,111 even if it does not contain any `.py` files. 2024-03-01T17:43:35,111 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,111 directory, all directories are treated like packages. 2024-03-01T17:43:35,111 ******************************************************************************** 2024-03-01T17:43:35,112 !! 2024-03-01T17:43:35,112 check.warn(importable) 2024-03-01T17:43:35,112 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos' is absent from the `packages` configuration. 2024-03-01T17:43:35,112 !! 2024-03-01T17:43:35,112 ******************************************************************************** 2024-03-01T17:43:35,112 ############################ 2024-03-01T17:43:35,112 # Package would be ignored # 2024-03-01T17:43:35,112 ############################ 2024-03-01T17:43:35,112 Python recognizes 'moleculekit.fileformats.binpos' as an importable package[^1], 2024-03-01T17:43:35,113 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,113 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,113 package, please make sure that 'moleculekit.fileformats.binpos' is explicitly added 2024-03-01T17:43:35,113 to the `packages` configuration field. 2024-03-01T17:43:35,113 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,113 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,113 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,114 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,114 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,114 If you don't want 'moleculekit.fileformats.binpos' to be distributed and are 2024-03-01T17:43:35,114 already explicitly excluding 'moleculekit.fileformats.binpos' via 2024-03-01T17:43:35,114 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,114 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,114 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,115 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,115 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,115 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,115 even if it does not contain any `.py` files. 2024-03-01T17:43:35,116 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,116 directory, all directories are treated like packages. 2024-03-01T17:43:35,116 ******************************************************************************** 2024-03-01T17:43:35,116 !! 2024-03-01T17:43:35,116 check.warn(importable) 2024-03-01T17:43:35,116 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos.include' is absent from the `packages` configuration. 2024-03-01T17:43:35,116 !! 2024-03-01T17:43:35,117 ******************************************************************************** 2024-03-01T17:43:35,117 ############################ 2024-03-01T17:43:35,117 # Package would be ignored # 2024-03-01T17:43:35,117 ############################ 2024-03-01T17:43:35,117 Python recognizes 'moleculekit.fileformats.binpos.include' as an importable package[^1], 2024-03-01T17:43:35,117 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,117 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,117 package, please make sure that 'moleculekit.fileformats.binpos.include' is explicitly added 2024-03-01T17:43:35,118 to the `packages` configuration field. 2024-03-01T17:43:35,118 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,118 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,118 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,118 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,118 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,119 If you don't want 'moleculekit.fileformats.binpos.include' to be distributed and are 2024-03-01T17:43:35,119 already explicitly excluding 'moleculekit.fileformats.binpos.include' via 2024-03-01T17:43:35,119 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,119 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,119 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,119 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,119 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,120 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,120 even if it does not contain any `.py` files. 2024-03-01T17:43:35,120 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,120 directory, all directories are treated like packages. 2024-03-01T17:43:35,120 ******************************************************************************** 2024-03-01T17:43:35,120 !! 2024-03-01T17:43:35,121 check.warn(importable) 2024-03-01T17:43:35,121 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos.src' is absent from the `packages` configuration. 2024-03-01T17:43:35,121 !! 2024-03-01T17:43:35,121 ******************************************************************************** 2024-03-01T17:43:35,121 ############################ 2024-03-01T17:43:35,121 # Package would be ignored # 2024-03-01T17:43:35,121 ############################ 2024-03-01T17:43:35,121 Python recognizes 'moleculekit.fileformats.binpos.src' as an importable package[^1], 2024-03-01T17:43:35,122 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,122 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,122 package, please make sure that 'moleculekit.fileformats.binpos.src' is explicitly added 2024-03-01T17:43:35,122 to the `packages` configuration field. 2024-03-01T17:43:35,122 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,122 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,122 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,123 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,123 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,123 If you don't want 'moleculekit.fileformats.binpos.src' to be distributed and are 2024-03-01T17:43:35,123 already explicitly excluding 'moleculekit.fileformats.binpos.src' via 2024-03-01T17:43:35,123 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,123 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,123 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,124 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,124 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,124 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,124 even if it does not contain any `.py` files. 2024-03-01T17:43:35,124 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,125 directory, all directories are treated like packages. 2024-03-01T17:43:35,125 ******************************************************************************** 2024-03-01T17:43:35,125 !! 2024-03-01T17:43:35,125 check.warn(importable) 2024-03-01T17:43:35,125 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd' is absent from the `packages` configuration. 2024-03-01T17:43:35,125 !! 2024-03-01T17:43:35,125 ******************************************************************************** 2024-03-01T17:43:35,126 ############################ 2024-03-01T17:43:35,126 # Package would be ignored # 2024-03-01T17:43:35,126 ############################ 2024-03-01T17:43:35,126 Python recognizes 'moleculekit.fileformats.dcd' as an importable package[^1], 2024-03-01T17:43:35,126 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,126 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,126 package, please make sure that 'moleculekit.fileformats.dcd' is explicitly added 2024-03-01T17:43:35,126 to the `packages` configuration field. 2024-03-01T17:43:35,127 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,127 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,127 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,127 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,127 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,128 If you don't want 'moleculekit.fileformats.dcd' to be distributed and are 2024-03-01T17:43:35,128 already explicitly excluding 'moleculekit.fileformats.dcd' via 2024-03-01T17:43:35,128 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,128 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,128 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,128 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,128 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,129 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,129 even if it does not contain any `.py` files. 2024-03-01T17:43:35,129 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,129 directory, all directories are treated like packages. 2024-03-01T17:43:35,129 ******************************************************************************** 2024-03-01T17:43:35,129 !! 2024-03-01T17:43:35,129 check.warn(importable) 2024-03-01T17:43:35,130 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd.include' is absent from the `packages` configuration. 2024-03-01T17:43:35,130 !! 2024-03-01T17:43:35,130 ******************************************************************************** 2024-03-01T17:43:35,130 ############################ 2024-03-01T17:43:35,130 # Package would be ignored # 2024-03-01T17:43:35,130 ############################ 2024-03-01T17:43:35,130 Python recognizes 'moleculekit.fileformats.dcd.include' as an importable package[^1], 2024-03-01T17:43:35,130 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,131 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,131 package, please make sure that 'moleculekit.fileformats.dcd.include' is explicitly added 2024-03-01T17:43:35,131 to the `packages` configuration field. 2024-03-01T17:43:35,131 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,131 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,131 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,132 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,132 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,132 If you don't want 'moleculekit.fileformats.dcd.include' to be distributed and are 2024-03-01T17:43:35,132 already explicitly excluding 'moleculekit.fileformats.dcd.include' via 2024-03-01T17:43:35,132 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,132 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,133 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,133 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,133 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,133 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,133 even if it does not contain any `.py` files. 2024-03-01T17:43:35,134 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,134 directory, all directories are treated like packages. 2024-03-01T17:43:35,134 ******************************************************************************** 2024-03-01T17:43:35,134 !! 2024-03-01T17:43:35,134 check.warn(importable) 2024-03-01T17:43:35,134 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd.src' is absent from the `packages` configuration. 2024-03-01T17:43:35,135 !! 2024-03-01T17:43:35,135 ******************************************************************************** 2024-03-01T17:43:35,135 ############################ 2024-03-01T17:43:35,135 # Package would be ignored # 2024-03-01T17:43:35,135 ############################ 2024-03-01T17:43:35,135 Python recognizes 'moleculekit.fileformats.dcd.src' as an importable package[^1], 2024-03-01T17:43:35,135 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,136 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,136 package, please make sure that 'moleculekit.fileformats.dcd.src' is explicitly added 2024-03-01T17:43:35,136 to the `packages` configuration field. 2024-03-01T17:43:35,136 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,136 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,136 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,136 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,137 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,137 If you don't want 'moleculekit.fileformats.dcd.src' to be distributed and are 2024-03-01T17:43:35,137 already explicitly excluding 'moleculekit.fileformats.dcd.src' via 2024-03-01T17:43:35,137 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,137 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,137 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,137 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,138 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,138 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,138 even if it does not contain any `.py` files. 2024-03-01T17:43:35,138 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,138 directory, all directories are treated like packages. 2024-03-01T17:43:35,138 ******************************************************************************** 2024-03-01T17:43:35,139 !! 2024-03-01T17:43:35,139 check.warn(importable) 2024-03-01T17:43:35,139 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc' is absent from the `packages` configuration. 2024-03-01T17:43:35,139 !! 2024-03-01T17:43:35,139 ******************************************************************************** 2024-03-01T17:43:35,139 ############################ 2024-03-01T17:43:35,139 # Package would be ignored # 2024-03-01T17:43:35,140 ############################ 2024-03-01T17:43:35,140 Python recognizes 'moleculekit.fileformats.xtc' as an importable package[^1], 2024-03-01T17:43:35,140 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,140 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,140 package, please make sure that 'moleculekit.fileformats.xtc' is explicitly added 2024-03-01T17:43:35,140 to the `packages` configuration field. 2024-03-01T17:43:35,140 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,141 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,141 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,141 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,141 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,141 If you don't want 'moleculekit.fileformats.xtc' to be distributed and are 2024-03-01T17:43:35,141 already explicitly excluding 'moleculekit.fileformats.xtc' via 2024-03-01T17:43:35,141 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,142 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,142 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,142 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,142 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,142 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,143 even if it does not contain any `.py` files. 2024-03-01T17:43:35,143 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,143 directory, all directories are treated like packages. 2024-03-01T17:43:35,143 ******************************************************************************** 2024-03-01T17:43:35,143 !! 2024-03-01T17:43:35,143 check.warn(importable) 2024-03-01T17:43:35,143 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc.include' is absent from the `packages` configuration. 2024-03-01T17:43:35,143 !! 2024-03-01T17:43:35,144 ******************************************************************************** 2024-03-01T17:43:35,144 ############################ 2024-03-01T17:43:35,144 # Package would be ignored # 2024-03-01T17:43:35,144 ############################ 2024-03-01T17:43:35,144 Python recognizes 'moleculekit.fileformats.xtc.include' as an importable package[^1], 2024-03-01T17:43:35,144 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,144 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,144 package, please make sure that 'moleculekit.fileformats.xtc.include' is explicitly added 2024-03-01T17:43:35,145 to the `packages` configuration field. 2024-03-01T17:43:35,145 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,145 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,145 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,145 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,145 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,146 If you don't want 'moleculekit.fileformats.xtc.include' to be distributed and are 2024-03-01T17:43:35,146 already explicitly excluding 'moleculekit.fileformats.xtc.include' via 2024-03-01T17:43:35,146 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,146 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,146 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,146 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,147 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,147 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,147 even if it does not contain any `.py` files. 2024-03-01T17:43:35,147 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,147 directory, all directories are treated like packages. 2024-03-01T17:43:35,147 ******************************************************************************** 2024-03-01T17:43:35,148 !! 2024-03-01T17:43:35,148 check.warn(importable) 2024-03-01T17:43:35,148 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc.src' is absent from the `packages` configuration. 2024-03-01T17:43:35,148 !! 2024-03-01T17:43:35,148 ******************************************************************************** 2024-03-01T17:43:35,148 ############################ 2024-03-01T17:43:35,148 # Package would be ignored # 2024-03-01T17:43:35,148 ############################ 2024-03-01T17:43:35,148 Python recognizes 'moleculekit.fileformats.xtc.src' as an importable package[^1], 2024-03-01T17:43:35,149 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,149 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,149 package, please make sure that 'moleculekit.fileformats.xtc.src' is explicitly added 2024-03-01T17:43:35,149 to the `packages` configuration field. 2024-03-01T17:43:35,150 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,150 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,150 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,150 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,150 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,151 If you don't want 'moleculekit.fileformats.xtc.src' to be distributed and are 2024-03-01T17:43:35,151 already explicitly excluding 'moleculekit.fileformats.xtc.src' via 2024-03-01T17:43:35,151 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,151 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,151 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,152 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,152 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,152 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,152 even if it does not contain any `.py` files. 2024-03-01T17:43:35,152 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,152 directory, all directories are treated like packages. 2024-03-01T17:43:35,153 ******************************************************************************** 2024-03-01T17:43:35,153 !! 2024-03-01T17:43:35,153 check.warn(importable) 2024-03-01T17:43:35,153 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.cationpi' is absent from the `packages` configuration. 2024-03-01T17:43:35,153 !! 2024-03-01T17:43:35,153 ******************************************************************************** 2024-03-01T17:43:35,153 ############################ 2024-03-01T17:43:35,154 # Package would be ignored # 2024-03-01T17:43:35,154 ############################ 2024-03-01T17:43:35,154 Python recognizes 'moleculekit.interactions.cationpi' as an importable package[^1], 2024-03-01T17:43:35,154 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,154 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,154 package, please make sure that 'moleculekit.interactions.cationpi' is explicitly added 2024-03-01T17:43:35,154 to the `packages` configuration field. 2024-03-01T17:43:35,155 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,155 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,155 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,155 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,156 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,156 If you don't want 'moleculekit.interactions.cationpi' to be distributed and are 2024-03-01T17:43:35,156 already explicitly excluding 'moleculekit.interactions.cationpi' via 2024-03-01T17:43:35,156 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,156 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,156 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,157 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,157 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,157 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,158 even if it does not contain any `.py` files. 2024-03-01T17:43:35,158 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,158 directory, all directories are treated like packages. 2024-03-01T17:43:35,158 ******************************************************************************** 2024-03-01T17:43:35,158 !! 2024-03-01T17:43:35,158 check.warn(importable) 2024-03-01T17:43:35,159 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.hbonds' is absent from the `packages` configuration. 2024-03-01T17:43:35,159 !! 2024-03-01T17:43:35,159 ******************************************************************************** 2024-03-01T17:43:35,159 ############################ 2024-03-01T17:43:35,159 # Package would be ignored # 2024-03-01T17:43:35,159 ############################ 2024-03-01T17:43:35,160 Python recognizes 'moleculekit.interactions.hbonds' as an importable package[^1], 2024-03-01T17:43:35,160 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,160 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,160 package, please make sure that 'moleculekit.interactions.hbonds' is explicitly added 2024-03-01T17:43:35,160 to the `packages` configuration field. 2024-03-01T17:43:35,161 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,161 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,161 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,161 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,161 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,162 If you don't want 'moleculekit.interactions.hbonds' to be distributed and are 2024-03-01T17:43:35,162 already explicitly excluding 'moleculekit.interactions.hbonds' via 2024-03-01T17:43:35,162 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,162 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,162 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,163 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,163 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,163 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,164 even if it does not contain any `.py` files. 2024-03-01T17:43:35,164 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,164 directory, all directories are treated like packages. 2024-03-01T17:43:35,164 ******************************************************************************** 2024-03-01T17:43:35,164 !! 2024-03-01T17:43:35,164 check.warn(importable) 2024-03-01T17:43:35,165 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.pipi' is absent from the `packages` configuration. 2024-03-01T17:43:35,165 !! 2024-03-01T17:43:35,165 ******************************************************************************** 2024-03-01T17:43:35,165 ############################ 2024-03-01T17:43:35,165 # Package would be ignored # 2024-03-01T17:43:35,166 ############################ 2024-03-01T17:43:35,166 Python recognizes 'moleculekit.interactions.pipi' as an importable package[^1], 2024-03-01T17:43:35,166 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,166 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,166 package, please make sure that 'moleculekit.interactions.pipi' is explicitly added 2024-03-01T17:43:35,166 to the `packages` configuration field. 2024-03-01T17:43:35,167 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,167 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,167 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,167 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,167 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,167 If you don't want 'moleculekit.interactions.pipi' to be distributed and are 2024-03-01T17:43:35,168 already explicitly excluding 'moleculekit.interactions.pipi' via 2024-03-01T17:43:35,168 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,168 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,168 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,168 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,168 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,169 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,169 even if it does not contain any `.py` files. 2024-03-01T17:43:35,169 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,169 directory, all directories are treated like packages. 2024-03-01T17:43:35,169 ******************************************************************************** 2024-03-01T17:43:35,169 !! 2024-03-01T17:43:35,170 check.warn(importable) 2024-03-01T17:43:35,170 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.sigmahole' is absent from the `packages` configuration. 2024-03-01T17:43:35,170 !! 2024-03-01T17:43:35,170 ******************************************************************************** 2024-03-01T17:43:35,170 ############################ 2024-03-01T17:43:35,170 # Package would be ignored # 2024-03-01T17:43:35,170 ############################ 2024-03-01T17:43:35,170 Python recognizes 'moleculekit.interactions.sigmahole' as an importable package[^1], 2024-03-01T17:43:35,171 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,171 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,171 package, please make sure that 'moleculekit.interactions.sigmahole' is explicitly added 2024-03-01T17:43:35,171 to the `packages` configuration field. 2024-03-01T17:43:35,171 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,172 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,172 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,172 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,173 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,174 If you don't want 'moleculekit.interactions.sigmahole' to be distributed and are 2024-03-01T17:43:35,174 already explicitly excluding 'moleculekit.interactions.sigmahole' via 2024-03-01T17:43:35,174 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,174 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,175 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,175 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,176 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,176 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,177 even if it does not contain any `.py` files. 2024-03-01T17:43:35,177 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,177 directory, all directories are treated like packages. 2024-03-01T17:43:35,177 ******************************************************************************** 2024-03-01T17:43:35,178 !! 2024-03-01T17:43:35,178 check.warn(importable) 2024-03-01T17:43:35,178 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.occupancy_utils' is absent from the `packages` configuration. 2024-03-01T17:43:35,178 !! 2024-03-01T17:43:35,179 ******************************************************************************** 2024-03-01T17:43:35,179 ############################ 2024-03-01T17:43:35,179 # Package would be ignored # 2024-03-01T17:43:35,180 ############################ 2024-03-01T17:43:35,180 Python recognizes 'moleculekit.occupancy_utils' as an importable package[^1], 2024-03-01T17:43:35,180 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,181 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,181 package, please make sure that 'moleculekit.occupancy_utils' is explicitly added 2024-03-01T17:43:35,181 to the `packages` configuration field. 2024-03-01T17:43:35,181 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,181 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,181 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,182 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,182 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,183 If you don't want 'moleculekit.occupancy_utils' to be distributed and are 2024-03-01T17:43:35,183 already explicitly excluding 'moleculekit.occupancy_utils' via 2024-03-01T17:43:35,183 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,184 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,184 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,184 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,185 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,185 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,186 even if it does not contain any `.py` files. 2024-03-01T17:43:35,186 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,186 directory, all directories are treated like packages. 2024-03-01T17:43:35,186 ******************************************************************************** 2024-03-01T17:43:35,187 !! 2024-03-01T17:43:35,187 check.warn(importable) 2024-03-01T17:43:35,187 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share' is absent from the `packages` configuration. 2024-03-01T17:43:35,187 !! 2024-03-01T17:43:35,188 ******************************************************************************** 2024-03-01T17:43:35,188 ############################ 2024-03-01T17:43:35,188 # Package would be ignored # 2024-03-01T17:43:35,188 ############################ 2024-03-01T17:43:35,189 Python recognizes 'moleculekit.share' as an importable package[^1], 2024-03-01T17:43:35,189 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,189 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,189 package, please make sure that 'moleculekit.share' is explicitly added 2024-03-01T17:43:35,189 to the `packages` configuration field. 2024-03-01T17:43:35,190 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,190 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,190 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,191 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,191 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,191 If you don't want 'moleculekit.share' to be distributed and are 2024-03-01T17:43:35,192 already explicitly excluding 'moleculekit.share' via 2024-03-01T17:43:35,192 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,192 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,192 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,192 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,193 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,193 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,194 even if it does not contain any `.py` files. 2024-03-01T17:43:35,194 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,194 directory, all directories are treated like packages. 2024-03-01T17:43:35,194 ******************************************************************************** 2024-03-01T17:43:35,194 !! 2024-03-01T17:43:35,195 check.warn(importable) 2024-03-01T17:43:35,195 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share.atomselect' is absent from the `packages` configuration. 2024-03-01T17:43:35,195 !! 2024-03-01T17:43:35,196 ******************************************************************************** 2024-03-01T17:43:35,196 ############################ 2024-03-01T17:43:35,196 # Package would be ignored # 2024-03-01T17:43:35,197 ############################ 2024-03-01T17:43:35,197 Python recognizes 'moleculekit.share.atomselect' as an importable package[^1], 2024-03-01T17:43:35,197 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,197 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,198 package, please make sure that 'moleculekit.share.atomselect' is explicitly added 2024-03-01T17:43:35,198 to the `packages` configuration field. 2024-03-01T17:43:35,198 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,198 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,199 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,199 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,200 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,200 If you don't want 'moleculekit.share.atomselect' to be distributed and are 2024-03-01T17:43:35,200 already explicitly excluding 'moleculekit.share.atomselect' via 2024-03-01T17:43:35,201 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,201 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,201 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,201 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,202 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,202 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,203 even if it does not contain any `.py` files. 2024-03-01T17:43:35,203 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,203 directory, all directories are treated like packages. 2024-03-01T17:43:35,203 ******************************************************************************** 2024-03-01T17:43:35,204 !! 2024-03-01T17:43:35,204 check.warn(importable) 2024-03-01T17:43:35,204 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share.pdb2pqr.residues' is absent from the `packages` configuration. 2024-03-01T17:43:35,204 !! 2024-03-01T17:43:35,204 ******************************************************************************** 2024-03-01T17:43:35,205 ############################ 2024-03-01T17:43:35,205 # Package would be ignored # 2024-03-01T17:43:35,205 ############################ 2024-03-01T17:43:35,205 Python recognizes 'moleculekit.share.pdb2pqr.residues' as an importable package[^1], 2024-03-01T17:43:35,205 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,206 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,206 package, please make sure that 'moleculekit.share.pdb2pqr.residues' is explicitly added 2024-03-01T17:43:35,206 to the `packages` configuration field. 2024-03-01T17:43:35,206 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,206 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,206 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,207 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,207 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,207 If you don't want 'moleculekit.share.pdb2pqr.residues' to be distributed and are 2024-03-01T17:43:35,207 already explicitly excluding 'moleculekit.share.pdb2pqr.residues' via 2024-03-01T17:43:35,208 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,208 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,208 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,208 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,208 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,209 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,209 even if it does not contain any `.py` files. 2024-03-01T17:43:35,209 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,209 directory, all directories are treated like packages. 2024-03-01T17:43:35,209 ******************************************************************************** 2024-03-01T17:43:35,209 !! 2024-03-01T17:43:35,210 check.warn(importable) 2024-03-01T17:43:35,210 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign' is absent from the `packages` configuration. 2024-03-01T17:43:35,210 !! 2024-03-01T17:43:35,210 ******************************************************************************** 2024-03-01T17:43:35,210 ############################ 2024-03-01T17:43:35,211 # Package would be ignored # 2024-03-01T17:43:35,211 ############################ 2024-03-01T17:43:35,211 Python recognizes 'moleculekit.tmalign' as an importable package[^1], 2024-03-01T17:43:35,211 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,211 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,211 package, please make sure that 'moleculekit.tmalign' is explicitly added 2024-03-01T17:43:35,211 to the `packages` configuration field. 2024-03-01T17:43:35,212 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,212 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,212 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,212 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,212 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,213 If you don't want 'moleculekit.tmalign' to be distributed and are 2024-03-01T17:43:35,213 already explicitly excluding 'moleculekit.tmalign' via 2024-03-01T17:43:35,213 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,213 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,213 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,213 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,214 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,214 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,214 even if it does not contain any `.py` files. 2024-03-01T17:43:35,214 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,214 directory, all directories are treated like packages. 2024-03-01T17:43:35,215 ******************************************************************************** 2024-03-01T17:43:35,215 !! 2024-03-01T17:43:35,215 check.warn(importable) 2024-03-01T17:43:35,215 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.include' is absent from the `packages` configuration. 2024-03-01T17:43:35,215 !! 2024-03-01T17:43:35,216 ******************************************************************************** 2024-03-01T17:43:35,216 ############################ 2024-03-01T17:43:35,216 # Package would be ignored # 2024-03-01T17:43:35,216 ############################ 2024-03-01T17:43:35,216 Python recognizes 'moleculekit.tmalign.include' as an importable package[^1], 2024-03-01T17:43:35,216 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,216 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,217 package, please make sure that 'moleculekit.tmalign.include' is explicitly added 2024-03-01T17:43:35,217 to the `packages` configuration field. 2024-03-01T17:43:35,217 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,217 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,217 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,217 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,218 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,218 If you don't want 'moleculekit.tmalign.include' to be distributed and are 2024-03-01T17:43:35,218 already explicitly excluding 'moleculekit.tmalign.include' via 2024-03-01T17:43:35,218 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,218 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,218 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,219 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,219 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,219 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,219 even if it does not contain any `.py` files. 2024-03-01T17:43:35,219 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,220 directory, all directories are treated like packages. 2024-03-01T17:43:35,220 ******************************************************************************** 2024-03-01T17:43:35,220 !! 2024-03-01T17:43:35,220 check.warn(importable) 2024-03-01T17:43:35,220 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.src' is absent from the `packages` configuration. 2024-03-01T17:43:35,221 !! 2024-03-01T17:43:35,221 ******************************************************************************** 2024-03-01T17:43:35,221 ############################ 2024-03-01T17:43:35,221 # Package would be ignored # 2024-03-01T17:43:35,221 ############################ 2024-03-01T17:43:35,221 Python recognizes 'moleculekit.tmalign.src' as an importable package[^1], 2024-03-01T17:43:35,221 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,222 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,222 package, please make sure that 'moleculekit.tmalign.src' is explicitly added 2024-03-01T17:43:35,222 to the `packages` configuration field. 2024-03-01T17:43:35,222 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,222 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,222 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,223 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,223 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,223 If you don't want 'moleculekit.tmalign.src' to be distributed and are 2024-03-01T17:43:35,223 already explicitly excluding 'moleculekit.tmalign.src' via 2024-03-01T17:43:35,223 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,224 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,224 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,224 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,224 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,224 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,225 even if it does not contain any `.py` files. 2024-03-01T17:43:35,225 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,225 directory, all directories are treated like packages. 2024-03-01T17:43:35,225 ******************************************************************************** 2024-03-01T17:43:35,226 !! 2024-03-01T17:43:35,226 check.warn(importable) 2024-03-01T17:43:35,226 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.wrapping' is absent from the `packages` configuration. 2024-03-01T17:43:35,226 !! 2024-03-01T17:43:35,226 ******************************************************************************** 2024-03-01T17:43:35,226 ############################ 2024-03-01T17:43:35,226 # Package would be ignored # 2024-03-01T17:43:35,227 ############################ 2024-03-01T17:43:35,227 Python recognizes 'moleculekit.wrapping' as an importable package[^1], 2024-03-01T17:43:35,227 but it is absent from setuptools' `packages` configuration. 2024-03-01T17:43:35,227 This leads to an ambiguous overall configuration. If you want to distribute this 2024-03-01T17:43:35,227 package, please make sure that 'moleculekit.wrapping' is explicitly added 2024-03-01T17:43:35,227 to the `packages` configuration field. 2024-03-01T17:43:35,228 Alternatively, you can also rely on setuptools' discovery methods 2024-03-01T17:43:35,228 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-03-01T17:43:35,228 instead of `find_packages(...)`/`find:`). 2024-03-01T17:43:35,228 You can read more about "package discovery" on setuptools documentation page: 2024-03-01T17:43:35,229 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-03-01T17:43:35,229 If you don't want 'moleculekit.wrapping' to be distributed and are 2024-03-01T17:43:35,229 already explicitly excluding 'moleculekit.wrapping' via 2024-03-01T17:43:35,229 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-03-01T17:43:35,229 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-03-01T17:43:35,229 combination with a more fine grained `package-data` configuration. 2024-03-01T17:43:35,230 You can read more about "package data files" on setuptools documentation page: 2024-03-01T17:43:35,230 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-03-01T17:43:35,230 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-03-01T17:43:35,230 even if it does not contain any `.py` files. 2024-03-01T17:43:35,230 On the other hand, currently there is no concept of package data 2024-03-01T17:43:35,231 directory, all directories are treated like packages. 2024-03-01T17:43:35,231 ******************************************************************************** 2024-03-01T17:43:35,231 !! 2024-03-01T17:43:35,231 check.warn(importable) 2024-03-01T17:43:35,231 copying moleculekit/logging.ini -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:35,232 copying moleculekit/vmd_wrapper -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:35,232 creating build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-03-01T17:43:35,232 copying moleculekit/atomselect_utils/atomselect_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-03-01T17:43:35,250 copying moleculekit/atomselect_utils/atomselect_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-03-01T17:43:35,260 creating build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-03-01T17:43:35,262 copying moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-03-01T17:43:35,301 copying moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-03-01T17:43:35,303 creating build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-03-01T17:43:35,304 copying moleculekit/cython_utils/cython_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-03-01T17:43:35,356 copying moleculekit/cython_utils/cython_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-03-01T17:43:35,359 creating build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-03-01T17:43:35,361 copying moleculekit/distance_utils/distance_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-03-01T17:43:35,403 copying moleculekit/distance_utils/distance_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-03-01T17:43:35,407 creating build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-03-01T17:43:35,407 copying moleculekit/occupancy_utils/occupancy_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-03-01T17:43:35,439 copying moleculekit/occupancy_utils/occupancy_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-03-01T17:43:35,441 creating build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-03-01T17:43:35,442 copying moleculekit/share/ALA.cif -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-03-01T17:43:35,445 copying moleculekit/share/backbone.cif -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-03-01T17:43:35,448 copying moleculekit/share/opm_sequences.json -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-03-01T17:43:35,764 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect 2024-03-01T17:43:35,765 copying moleculekit/share/atomselect/atomselect.json -> build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect 2024-03-01T17:43:35,767 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr 2024-03-01T17:43:35,768 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,769 copying moleculekit/share/pdb2pqr/residues/.gitkeep -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,771 copying moleculekit/share/pdb2pqr/residues/004.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,774 copying moleculekit/share/pdb2pqr/residues/004.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,776 copying moleculekit/share/pdb2pqr/residues/03Y.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,778 copying moleculekit/share/pdb2pqr/residues/03Y.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,781 copying moleculekit/share/pdb2pqr/residues/0A1.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,783 copying moleculekit/share/pdb2pqr/residues/0A1.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,785 copying moleculekit/share/pdb2pqr/residues/0AF.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,789 copying moleculekit/share/pdb2pqr/residues/0AF.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,792 copying moleculekit/share/pdb2pqr/residues/0BN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,795 copying moleculekit/share/pdb2pqr/residues/0BN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,798 copying moleculekit/share/pdb2pqr/residues/1MH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,800 copying moleculekit/share/pdb2pqr/residues/1MH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,803 copying moleculekit/share/pdb2pqr/residues/2AS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,805 copying moleculekit/share/pdb2pqr/residues/2AS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,808 copying moleculekit/share/pdb2pqr/residues/2GX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,810 copying moleculekit/share/pdb2pqr/residues/2GX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,814 copying moleculekit/share/pdb2pqr/residues/2ML.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,816 copying moleculekit/share/pdb2pqr/residues/2ML.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,818 copying moleculekit/share/pdb2pqr/residues/2MR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,821 copying moleculekit/share/pdb2pqr/residues/2MR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,824 copying moleculekit/share/pdb2pqr/residues/4IN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,827 copying moleculekit/share/pdb2pqr/residues/4IN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,830 copying moleculekit/share/pdb2pqr/residues/4PH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,832 copying moleculekit/share/pdb2pqr/residues/4PH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,835 copying moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,838 copying moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,841 copying moleculekit/share/pdb2pqr/residues/5JP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,844 copying moleculekit/share/pdb2pqr/residues/5JP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,847 copying moleculekit/share/pdb2pqr/residues/AA4.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,850 copying moleculekit/share/pdb2pqr/residues/AA4.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,853 copying moleculekit/share/pdb2pqr/residues/ABA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,855 copying moleculekit/share/pdb2pqr/residues/ABA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,858 copying moleculekit/share/pdb2pqr/residues/AHP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,860 copying moleculekit/share/pdb2pqr/residues/AHP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,863 copying moleculekit/share/pdb2pqr/residues/ALC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,866 copying moleculekit/share/pdb2pqr/residues/ALC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,869 copying moleculekit/share/pdb2pqr/residues/ALN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,872 copying moleculekit/share/pdb2pqr/residues/ALN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,875 copying moleculekit/share/pdb2pqr/residues/ALY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,877 copying moleculekit/share/pdb2pqr/residues/ALY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,880 copying moleculekit/share/pdb2pqr/residues/APD.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,883 copying moleculekit/share/pdb2pqr/residues/APD.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,885 copying moleculekit/share/pdb2pqr/residues/BB8.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:35,888 copying moleculekit/share/pdb2pqr/residues/BB8.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,106 copying moleculekit/share/pdb2pqr/residues/BCS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,108 copying moleculekit/share/pdb2pqr/residues/BCS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,110 copying moleculekit/share/pdb2pqr/residues/BTK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,112 copying moleculekit/share/pdb2pqr/residues/BTK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,115 copying moleculekit/share/pdb2pqr/residues/CCS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,117 copying moleculekit/share/pdb2pqr/residues/CCS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,119 copying moleculekit/share/pdb2pqr/residues/CGU.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,122 copying moleculekit/share/pdb2pqr/residues/CGU.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,124 copying moleculekit/share/pdb2pqr/residues/CSA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,126 copying moleculekit/share/pdb2pqr/residues/CSA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,128 copying moleculekit/share/pdb2pqr/residues/CSO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,131 copying moleculekit/share/pdb2pqr/residues/CSO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,134 copying moleculekit/share/pdb2pqr/residues/CSP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,137 copying moleculekit/share/pdb2pqr/residues/CSP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,140 copying moleculekit/share/pdb2pqr/residues/CSS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,143 copying moleculekit/share/pdb2pqr/residues/CSS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,147 copying moleculekit/share/pdb2pqr/residues/D4P.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,150 copying moleculekit/share/pdb2pqr/residues/D4P.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,154 copying moleculekit/share/pdb2pqr/residues/DA2.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,157 copying moleculekit/share/pdb2pqr/residues/DA2.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,162 copying moleculekit/share/pdb2pqr/residues/DAB.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,166 copying moleculekit/share/pdb2pqr/residues/DAB.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,170 copying moleculekit/share/pdb2pqr/residues/DAH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,172 copying moleculekit/share/pdb2pqr/residues/DAH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,174 copying moleculekit/share/pdb2pqr/residues/DPP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,176 copying moleculekit/share/pdb2pqr/residues/DPP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,178 copying moleculekit/share/pdb2pqr/residues/ESC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,180 copying moleculekit/share/pdb2pqr/residues/ESC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,183 copying moleculekit/share/pdb2pqr/residues/FGL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,185 copying moleculekit/share/pdb2pqr/residues/FGL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,187 copying moleculekit/share/pdb2pqr/residues/GHG.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,189 copying moleculekit/share/pdb2pqr/residues/GHG.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,191 copying moleculekit/share/pdb2pqr/residues/GME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,193 copying moleculekit/share/pdb2pqr/residues/GME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,195 copying moleculekit/share/pdb2pqr/residues/GNC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,197 copying moleculekit/share/pdb2pqr/residues/GNC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,416 copying moleculekit/share/pdb2pqr/residues/HHK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,418 copying moleculekit/share/pdb2pqr/residues/HHK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,421 copying moleculekit/share/pdb2pqr/residues/HLU.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,424 copying moleculekit/share/pdb2pqr/residues/HLU.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,438 copying moleculekit/share/pdb2pqr/residues/HLX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,440 copying moleculekit/share/pdb2pqr/residues/HLX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,443 copying moleculekit/share/pdb2pqr/residues/HOX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,445 copying moleculekit/share/pdb2pqr/residues/HOX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,448 copying moleculekit/share/pdb2pqr/residues/HPE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,450 copying moleculekit/share/pdb2pqr/residues/HPE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,452 copying moleculekit/share/pdb2pqr/residues/HQA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,455 copying moleculekit/share/pdb2pqr/residues/HQA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,457 copying moleculekit/share/pdb2pqr/residues/HTR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,459 copying moleculekit/share/pdb2pqr/residues/HTR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,461 copying moleculekit/share/pdb2pqr/residues/HYP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,463 copying moleculekit/share/pdb2pqr/residues/HYP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,466 copying moleculekit/share/pdb2pqr/residues/I2M.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,468 copying moleculekit/share/pdb2pqr/residues/I2M.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,471 copying moleculekit/share/pdb2pqr/residues/IGL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,473 copying moleculekit/share/pdb2pqr/residues/IGL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,476 copying moleculekit/share/pdb2pqr/residues/IIL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,478 copying moleculekit/share/pdb2pqr/residues/IIL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,480 copying moleculekit/share/pdb2pqr/residues/IML.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,483 copying moleculekit/share/pdb2pqr/residues/IML.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,486 copying moleculekit/share/pdb2pqr/residues/KYN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,488 copying moleculekit/share/pdb2pqr/residues/KYN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,490 copying moleculekit/share/pdb2pqr/residues/LME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,492 copying moleculekit/share/pdb2pqr/residues/LME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,495 copying moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,497 copying moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,499 copying moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,501 copying moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,503 copying moleculekit/share/pdb2pqr/residues/M3L.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,505 copying moleculekit/share/pdb2pqr/residues/M3L.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,508 copying moleculekit/share/pdb2pqr/residues/ME0.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,509 copying moleculekit/share/pdb2pqr/residues/ME0.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,511 copying moleculekit/share/pdb2pqr/residues/MEA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,513 copying moleculekit/share/pdb2pqr/residues/MEA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,516 copying moleculekit/share/pdb2pqr/residues/MEN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,519 copying moleculekit/share/pdb2pqr/residues/MEN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,522 copying moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,527 copying moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,532 copying moleculekit/share/pdb2pqr/residues/MLE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,536 copying moleculekit/share/pdb2pqr/residues/MLE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,540 copying moleculekit/share/pdb2pqr/residues/MLY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,544 copying moleculekit/share/pdb2pqr/residues/MLY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,548 copying moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,551 copying moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,554 copying moleculekit/share/pdb2pqr/residues/MME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,558 copying moleculekit/share/pdb2pqr/residues/MME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,562 copying moleculekit/share/pdb2pqr/residues/MMO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,566 copying moleculekit/share/pdb2pqr/residues/MMO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,571 copying moleculekit/share/pdb2pqr/residues/MVA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,576 copying moleculekit/share/pdb2pqr/residues/MVA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,579 copying moleculekit/share/pdb2pqr/residues/NAL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,581 copying moleculekit/share/pdb2pqr/residues/NAL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,583 copying moleculekit/share/pdb2pqr/residues/NCY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,585 copying moleculekit/share/pdb2pqr/residues/NCY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,587 copying moleculekit/share/pdb2pqr/residues/NLE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,589 copying moleculekit/share/pdb2pqr/residues/NLE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,591 copying moleculekit/share/pdb2pqr/residues/NVA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,594 copying moleculekit/share/pdb2pqr/residues/NVA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,597 copying moleculekit/share/pdb2pqr/residues/NZC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,600 copying moleculekit/share/pdb2pqr/residues/NZC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,603 copying moleculekit/share/pdb2pqr/residues/OCY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,607 copying moleculekit/share/pdb2pqr/residues/OCY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,610 copying moleculekit/share/pdb2pqr/residues/OMX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,613 copying moleculekit/share/pdb2pqr/residues/OMX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,616 copying moleculekit/share/pdb2pqr/residues/ONL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,620 copying moleculekit/share/pdb2pqr/residues/ONL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,623 copying moleculekit/share/pdb2pqr/residues/ORM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,626 copying moleculekit/share/pdb2pqr/residues/ORM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,630 copying moleculekit/share/pdb2pqr/residues/P1L.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,633 copying moleculekit/share/pdb2pqr/residues/P1L.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,637 copying moleculekit/share/pdb2pqr/residues/PCA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,640 copying moleculekit/share/pdb2pqr/residues/PCA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,644 copying moleculekit/share/pdb2pqr/residues/PRK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,647 copying moleculekit/share/pdb2pqr/residues/PRK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,651 copying moleculekit/share/pdb2pqr/residues/PTR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,654 copying moleculekit/share/pdb2pqr/residues/PTR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,658 copying moleculekit/share/pdb2pqr/residues/SEP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,661 copying moleculekit/share/pdb2pqr/residues/SEP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,665 copying moleculekit/share/pdb2pqr/residues/TPO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,670 copying moleculekit/share/pdb2pqr/residues/TPO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,675 copying moleculekit/share/pdb2pqr/residues/TRO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,679 copying moleculekit/share/pdb2pqr/residues/TRO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,683 copying moleculekit/share/pdb2pqr/residues/TY2.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,686 copying moleculekit/share/pdb2pqr/residues/TY2.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,689 copying moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,693 copying moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,695 copying moleculekit/share/pdb2pqr/residues/YCM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,698 copying moleculekit/share/pdb2pqr/residues/YCM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,701 copying moleculekit/share/pdb2pqr/residues/YNM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,916 copying moleculekit/share/pdb2pqr/residues/YNM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-03-01T17:43:36,918 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-03-01T17:43:36,918 copying moleculekit/tmalign/tmalign_util.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-03-01T17:43:36,980 copying moleculekit/tmalign/tmalign_util.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-03-01T17:43:36,992 copying moleculekit/tmalign/tmalignlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-03-01T17:43:36,995 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include 2024-03-01T17:43:36,996 copying moleculekit/tmalign/include/TMAlign.h -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include 2024-03-01T17:43:37,007 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-03-01T17:43:37,007 copying moleculekit/tmalign/src/TMAlign.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-03-01T17:43:37,014 creating build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-03-01T17:43:37,015 copying moleculekit/wrapping/wrapping.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-03-01T17:43:37,075 copying moleculekit/wrapping/wrapping.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-03-01T17:43:37,078 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-03-01T17:43:37,079 copying moleculekit/interactions/cationpi/cationpi.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-03-01T17:43:37,127 copying moleculekit/interactions/cationpi/cationpi.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-03-01T17:43:37,130 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-03-01T17:43:37,131 copying moleculekit/interactions/hbonds/hbonds.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-03-01T17:43:37,171 copying moleculekit/interactions/hbonds/hbonds.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-03-01T17:43:37,175 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-03-01T17:43:37,177 copying moleculekit/interactions/pipi/pipi.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-03-01T17:43:37,209 copying moleculekit/interactions/pipi/pipi.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-03-01T17:43:37,211 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-03-01T17:43:37,212 copying moleculekit/interactions/sigmahole/sigmahole.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-03-01T17:43:37,241 copying moleculekit/interactions/sigmahole/sigmahole.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-03-01T17:43:37,244 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-03-01T17:43:37,245 copying moleculekit/fileformats/binpos/binpos.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-03-01T17:43:37,266 copying moleculekit/fileformats/binpos/binpos.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-03-01T17:43:37,270 copying moleculekit/fileformats/binpos/binposlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-03-01T17:43:37,272 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-03-01T17:43:37,273 copying moleculekit/fileformats/binpos/include/binposplugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-03-01T17:43:37,276 copying moleculekit/fileformats/binpos/include/largefiles.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-03-01T17:43:37,279 copying moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-03-01T17:43:37,283 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-03-01T17:43:37,284 copying moleculekit/fileformats/binpos/src/binposplugin.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-03-01T17:43:37,288 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-03-01T17:43:37,289 copying moleculekit/fileformats/dcd/dcd.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-03-01T17:43:37,321 copying moleculekit/fileformats/dcd/dcd.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-03-01T17:43:37,325 copying moleculekit/fileformats/dcd/dcdlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-03-01T17:43:37,327 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-03-01T17:43:37,329 copying moleculekit/fileformats/dcd/include/dcdplugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-03-01T17:43:37,331 copying moleculekit/fileformats/dcd/include/endianswap.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-03-01T17:43:37,335 copying moleculekit/fileformats/dcd/include/fastio.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-03-01T17:43:37,338 copying moleculekit/fileformats/dcd/include/largefiles.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-03-01T17:43:37,341 copying moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-03-01T17:43:37,346 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-03-01T17:43:37,347 copying moleculekit/fileformats/dcd/src/dcdplugin.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-03-01T17:43:37,354 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-03-01T17:43:37,356 copying moleculekit/fileformats/xtc/trr.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-03-01T17:43:37,459 copying moleculekit/fileformats/xtc/trr.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-03-01T17:43:37,465 copying moleculekit/fileformats/xtc/trrlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-03-01T17:43:37,469 copying moleculekit/fileformats/xtc/xdrlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-03-01T17:43:37,473 copying moleculekit/fileformats/xtc/xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-03-01T17:43:37,536 copying moleculekit/fileformats/xtc/xtc.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-03-01T17:43:37,540 copying moleculekit/fileformats/xtc/xtclib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-03-01T17:43:37,543 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-03-01T17:43:37,545 copying moleculekit/fileformats/xtc/include/trr_header.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-03-01T17:43:37,549 copying moleculekit/fileformats/xtc/include/xdr_seek.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-03-01T17:43:37,552 copying moleculekit/fileformats/xtc/include/xdrfile.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-03-01T17:43:37,557 copying moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-03-01T17:43:37,561 copying moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-03-01T17:43:37,564 copying moleculekit/fileformats/xtc/include/xtc.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-03-01T17:43:37,567 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-03-01T17:43:37,568 copying moleculekit/fileformats/xtc/src/xdr_seek.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-03-01T17:43:37,571 copying moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-03-01T17:43:37,581 copying moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-03-01T17:43:37,590 copying moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-03-01T17:43:37,594 copying moleculekit/fileformats/xtc/src/xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-03-01T17:43:37,607 UPDATING build/lib.linux-armv7l-cpython-39/moleculekit/_version.py 2024-03-01T17:43:37,607 set build/lib.linux-armv7l-cpython-39/moleculekit/_version.py to '1.8.26' 2024-03-01T17:43:37,607 running build_ext 2024-03-01T17:43:37,618 building 'moleculekit.interactions.hbonds' extension 2024-03-01T17:43:37,619 creating build/temp.linux-armv7l-cpython-39 2024-03-01T17:43:37,620 creating build/temp.linux-armv7l-cpython-39/moleculekit 2024-03-01T17:43:37,620 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions 2024-03-01T17:43:37,621 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-03-01T17:43:37,622 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/interactions/hbonds/hbonds.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.o -O3 2024-03-01T17:43:37,905 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:43:37,905 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:43:37,905 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:43:37,905 from moleculekit/interactions/hbonds/hbonds.cpp:1230: 2024-03-01T17:43:37,906 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:43:37,906 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:43:37,906 | ^~~~~~~ 2024-03-01T17:44:01,578 moleculekit/interactions/hbonds/hbonds.cpp: In function ‘PyObject* __pyx_pw_11moleculekit_12interactions_6hbonds_1calculate(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-03-01T17:44:01,578 moleculekit/interactions/hbonds/hbonds.cpp:21001:52: warning: ‘__pyx_v_d_idx_h’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:44:01,578 21001 | (__pyx_v_results[__pyx_v_f]).push_back(__pyx_v_d_idx_h); 2024-03-01T17:44:01,578 | ^~~~~~~~~~~~~~~ 2024-03-01T17:44:01,579 moleculekit/interactions/hbonds/hbonds.cpp:20014:57: note: ‘__pyx_v_d_idx_h’ was declared here 2024-03-01T17:44:01,579 20014 | __pyx_t_11moleculekit_12interactions_6hbonds_UINT32_t __pyx_v_d_idx_h; 2024-03-01T17:44:01,579 | ^~~~~~~~~~~~~~~ 2024-03-01T17:44:04,821 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:44:05,144 building 'moleculekit.interactions.pipi' extension 2024-03-01T17:44:05,145 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-03-01T17:44:05,145 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/interactions/pipi/pipi.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.o -O3 2024-03-01T17:44:05,381 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:44:05,382 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:44:05,382 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:44:05,382 from moleculekit/interactions/pipi/pipi.cpp:1230: 2024-03-01T17:44:05,382 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:44:05,382 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:44:05,382 | ^~~~~~~ 2024-03-01T17:44:33,718 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:44:34,057 building 'moleculekit.interactions.cationpi' extension 2024-03-01T17:44:34,058 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-03-01T17:44:34,058 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/interactions/cationpi/cationpi.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.o -O3 2024-03-01T17:44:34,297 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:44:34,297 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:44:34,297 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:44:34,298 from moleculekit/interactions/cationpi/cationpi.cpp:1230: 2024-03-01T17:44:34,298 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:44:34,298 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:44:34,298 | ^~~~~~~ 2024-03-01T17:45:02,519 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:45:02,849 building 'moleculekit.interactions.sigmahole' extension 2024-03-01T17:45:02,849 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-03-01T17:45:02,850 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/interactions/sigmahole/sigmahole.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.o -O3 2024-03-01T17:45:03,100 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:45:03,100 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:45:03,100 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:45:03,100 from moleculekit/interactions/sigmahole/sigmahole.cpp:1230: 2024-03-01T17:45:03,100 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:45:03,100 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:45:03,100 | ^~~~~~~ 2024-03-01T17:45:30,576 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:45:30,917 building 'moleculekit.wrapping' extension 2024-03-01T17:45:30,917 creating build/temp.linux-armv7l-cpython-39/moleculekit/wrapping 2024-03-01T17:45:30,918 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/wrapping/wrapping.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.o -O3 2024-03-01T17:45:31,156 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:45:31,156 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:45:31,156 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:45:31,156 from moleculekit/wrapping/wrapping.cpp:1230: 2024-03-01T17:45:31,156 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:45:31,157 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:45:31,157 | ^~~~~~~ 2024-03-01T17:45:57,156 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:45:57,386 building 'moleculekit.bondguesser_utils' extension 2024-03-01T17:45:57,386 creating build/temp.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-03-01T17:45:57,387 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/bondguesser_utils/bondguesser_utils.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.o -O3 2024-03-01T17:45:57,630 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:45:57,630 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:45:57,630 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:45:57,630 from moleculekit/bondguesser_utils/bondguesser_utils.cpp:1230: 2024-03-01T17:45:57,630 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:45:57,630 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:45:57,630 | ^~~~~~~ 2024-03-01T17:45:59,185 moleculekit/bondguesser_utils/bondguesser_utils.cpp: In function ‘PyObject* __pyx_pf_11moleculekit_17bondguesser_utils_make_grid_neighborlist_nonperiodic(PyObject*, __Pyx_memviewslice, __pyx_t_11moleculekit_17bondguesser_utils_UINT32_t, __pyx_t_11moleculekit_17bondguesser_utils_UINT32_t, __pyx_t_11moleculekit_17bondguesser_utils_UINT32_t)’: 2024-03-01T17:45:59,186 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19783:33: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-03-01T17:45:59,186 19783 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-03-01T17:45:59,186 | ~~~~~~~~~~^~~~~~~~~~~ 2024-03-01T17:45:59,187 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19795:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-03-01T17:45:59,187 19795 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-03-01T17:45:59,187 | ~~~~~~~~~~^~~~~~~~~~~ 2024-03-01T17:45:59,187 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19807:37: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-03-01T17:45:59,188 19807 | for (__pyx_t_9 = 0; __pyx_t_9 < __pyx_t_8; __pyx_t_9+=1) { 2024-03-01T17:45:59,188 | ~~~~~~~~~~^~~~~~~~~~~ 2024-03-01T17:45:59,189 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19846:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,189 19846 | __pyx_t_12 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-03-01T17:45:59,189 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,190 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19885:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,190 19885 | __pyx_t_12 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-03-01T17:45:59,190 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,191 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19924:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,191 19924 | __pyx_t_12 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-03-01T17:45:59,191 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,192 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19963:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,192 19963 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-03-01T17:45:59,192 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,192 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19969:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,193 19969 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-03-01T17:45:59,193 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,194 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20010:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,194 20010 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-03-01T17:45:59,194 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,194 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20016:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,194 20016 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-03-01T17:45:59,195 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,195 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20057:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,196 20057 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-03-01T17:45:59,196 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,196 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20063:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,196 20063 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-03-01T17:45:59,197 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,197 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20104:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,198 20104 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-03-01T17:45:59,198 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,199 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20157:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,199 20157 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-03-01T17:45:59,199 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,200 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20204:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,200 20204 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-03-01T17:45:59,200 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,201 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20245:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,201 20245 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-03-01T17:45:59,201 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,202 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20251:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,202 20251 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-03-01T17:45:59,202 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,202 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20257:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,203 20257 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-03-01T17:45:59,203 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,203 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20304:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,204 20304 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-03-01T17:45:59,204 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,204 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20310:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,204 20310 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-03-01T17:45:59,205 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,205 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20351:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,205 20351 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-03-01T17:45:59,206 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,206 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20363:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,206 20363 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-03-01T17:45:59,206 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,207 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20416:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-03-01T17:45:59,208 20416 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-03-01T17:45:59,208 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,227 moleculekit/bondguesser_utils/bondguesser_utils.cpp: In function ‘PyObject* __pyx_pf_11moleculekit_17bondguesser_utils_2grid_bonds(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, __Pyx_memviewslice, float, int, __Pyx_memviewslice, __Pyx_memviewslice)’: 2024-03-01T17:45:59,228 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21038:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-03-01T17:45:59,228 21038 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_n_boxes); 2024-03-01T17:45:59,228 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~ 2024-03-01T17:45:59,228 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21075:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-03-01T17:45:59,229 21075 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_boxidx); 2024-03-01T17:45:59,229 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-03-01T17:46:22,421 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:46:22,732 building 'moleculekit.atomselect_utils' extension 2024-03-01T17:46:22,733 creating build/temp.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-03-01T17:46:22,734 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/atomselect_utils/atomselect_utils.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.o -O3 2024-03-01T17:46:22,973 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:46:22,974 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:46:22,974 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:46:22,974 from moleculekit/atomselect_utils/atomselect_utils.cpp:1247: 2024-03-01T17:46:22,974 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:46:22,974 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:46:22,974 | ^~~~~~~ 2024-03-01T17:46:24,685 moleculekit/atomselect_utils/atomselect_utils.cpp: In function ‘bool __pyx_f_11moleculekit_16atomselect_utils__find_connected_subfragment(int, int, const char*, const char*, const char*, __Pyx_memviewslice, __Pyx_memviewslice, __Pyx_memviewslice, std::vector >&, __Pyx_memviewslice, std::vector >&, std::vector >&, std::vector >&)’: 2024-03-01T17:46:24,685 moleculekit/atomselect_utils/atomselect_utils.cpp:23237:161: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-03-01T17:46:24,686 23237 | __pyx_t_3 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_2 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_resnum); 2024-03-01T17:46:24,686 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-03-01T17:46:24,690 moleculekit/atomselect_utils/atomselect_utils.cpp: In function ‘bool __pyx_f_11moleculekit_16atomselect_utils__find_subfragments(int, std::vector >&, std::vector >&, __Pyx_memviewslice, __Pyx_memviewslice, __Pyx_memviewslice, std::vector >&, __Pyx_memviewslice, std::vector >&)’: 2024-03-01T17:46:24,691 moleculekit/atomselect_utils/atomselect_utils.cpp:23489:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-03-01T17:46:24,691 23489 | __pyx_t_6 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_5 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_i); 2024-03-01T17:46:24,691 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-03-01T17:46:24,696 moleculekit/atomselect_utils/atomselect_utils.cpp: In function ‘bool __pyx_f_11moleculekit_16atomselect_utils__find_subfragments_topologically(int, std::vector >&, std::vector >&, __Pyx_memviewslice, __Pyx_memviewslice, __Pyx_memviewslice, std::vector >&, __Pyx_memviewslice, std::vector >&)’: 2024-03-01T17:46:24,696 moleculekit/atomselect_utils/atomselect_utils.cpp:23756:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-03-01T17:46:24,696 23756 | __pyx_t_6 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_5 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_i); 2024-03-01T17:46:24,697 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-03-01T17:46:55,113 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:46:55,452 building 'moleculekit.distance_utils' extension 2024-03-01T17:46:55,452 creating build/temp.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-03-01T17:46:55,453 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/distance_utils/distance_utils.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.o -O3 2024-03-01T17:46:55,691 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:46:55,691 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:46:55,691 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:46:55,691 from moleculekit/distance_utils/distance_utils.cpp:1230: 2024-03-01T17:46:55,691 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:46:55,691 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:46:55,692 | ^~~~~~~ 2024-03-01T17:46:57,336 moleculekit/distance_utils/distance_utils.cpp: In function ‘PyObject* __pyx_pf_11moleculekit_14distance_utils_2get_collisions(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, float)’: 2024-03-01T17:46:57,337 moleculekit/distance_utils/distance_utils.cpp:21341:33: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_14distance_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-03-01T17:46:57,337 21341 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-03-01T17:46:57,337 | ~~~~~~~~~~^~~~~~~~~~~ 2024-03-01T17:46:57,338 moleculekit/distance_utils/distance_utils.cpp:21353:35: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_14distance_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-03-01T17:46:57,338 21353 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-03-01T17:46:57,338 | ~~~~~~~~~~^~~~~~~~~~~ 2024-03-01T17:47:30,606 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:47:30,955 building 'moleculekit.occupancy_utils' extension 2024-03-01T17:47:30,956 creating build/temp.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-03-01T17:47:30,956 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/occupancy_utils/occupancy_utils.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.o -O3 2024-03-01T17:47:31,205 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:47:31,205 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:47:31,205 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:47:31,206 from moleculekit/occupancy_utils/occupancy_utils.cpp:1230: 2024-03-01T17:47:31,206 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:47:31,206 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:47:31,206 | ^~~~~~~ 2024-03-01T17:47:54,347 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:47:54,565 building 'moleculekit.cython_utils' extension 2024-03-01T17:47:54,566 creating build/temp.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-03-01T17:47:54,567 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/cython_utils/cython_utils.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.o -O3 2024-03-01T17:47:54,805 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:47:54,805 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:47:54,805 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:47:54,805 from moleculekit/cython_utils/cython_utils.cpp:1230: 2024-03-01T17:47:54,806 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:47:54,806 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:47:54,806 | ^~~~~~~ 2024-03-01T17:48:20,511 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:48:20,856 building 'moleculekit.xtc' extension 2024-03-01T17:48:20,858 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats 2024-03-01T17:48:20,859 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-03-01T17:48:20,862 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-03-01T17:48:20,865 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/xtc -Imoleculekit/fileformats/xtc/include/ -Imoleculekit/fileformats/xtc/ -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/fileformats/xtc/src/xdrfile.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile.o 2024-03-01T17:48:21,148 moleculekit/fileformats/xtc/src/xdrfile.cpp:66:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,148 66 | "OK", 2024-03-01T17:48:21,148 | ^~~~ 2024-03-01T17:48:21,148 moleculekit/fileformats/xtc/src/xdrfile.cpp:67:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,149 67 | "Header", 2024-03-01T17:48:21,149 | ^~~~~~~~ 2024-03-01T17:48:21,149 moleculekit/fileformats/xtc/src/xdrfile.cpp:68:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,149 68 | "String", 2024-03-01T17:48:21,149 | ^~~~~~~~ 2024-03-01T17:48:21,149 moleculekit/fileformats/xtc/src/xdrfile.cpp:69:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,150 69 | "Double", 2024-03-01T17:48:21,150 | ^~~~~~~~ 2024-03-01T17:48:21,150 moleculekit/fileformats/xtc/src/xdrfile.cpp:70:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,150 70 | "Integer", 2024-03-01T17:48:21,150 | ^~~~~~~~~ 2024-03-01T17:48:21,150 moleculekit/fileformats/xtc/src/xdrfile.cpp:71:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,151 71 | "Float", 2024-03-01T17:48:21,151 | ^~~~~~~ 2024-03-01T17:48:21,151 moleculekit/fileformats/xtc/src/xdrfile.cpp:72:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,151 72 | "Unsigned integer", 2024-03-01T17:48:21,151 | ^~~~~~~~~~~~~~~~~~ 2024-03-01T17:48:21,151 moleculekit/fileformats/xtc/src/xdrfile.cpp:73:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,152 73 | "Compressed 3D coordinate", 2024-03-01T17:48:21,152 | ^~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:48:21,152 moleculekit/fileformats/xtc/src/xdrfile.cpp:74:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,152 74 | "Closing file", 2024-03-01T17:48:21,152 | ^~~~~~~~~~~~~~ 2024-03-01T17:48:21,152 moleculekit/fileformats/xtc/src/xdrfile.cpp:75:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,153 75 | "Magic number", 2024-03-01T17:48:21,153 | ^~~~~~~~~~~~~~ 2024-03-01T17:48:21,153 moleculekit/fileformats/xtc/src/xdrfile.cpp:76:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,153 76 | "Not enough memory", 2024-03-01T17:48:21,153 | ^~~~~~~~~~~~~~~~~~~ 2024-03-01T17:48:21,153 moleculekit/fileformats/xtc/src/xdrfile.cpp:77:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,154 77 | "End of file", 2024-03-01T17:48:21,154 | ^~~~~~~~~~~~~ 2024-03-01T17:48:21,154 moleculekit/fileformats/xtc/src/xdrfile.cpp:78:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-03-01T17:48:21,154 78 | "File not found" 2024-03-01T17:48:21,154 | ^~~~~~~~~~~~~~~~ 2024-03-01T17:48:21,162 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofint(int)’: 2024-03-01T17:48:21,162 moleculekit/fileformats/xtc/src/xdrfile.cpp:459:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,163 459 | while (size >= num && num_of_bits < 32) 2024-03-01T17:48:21,163 | ~~~~~^~~~~~ 2024-03-01T17:48:21,164 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-03-01T17:48:21,164 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:21,164 505 | while (bytes[num_of_bytes] >= num) 2024-03-01T17:48:21,164 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-03-01T17:48:21,167 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-03-01T17:48:21,167 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,167 614 | if (num_of_bits >= num_of_bytes * 8) 2024-03-01T17:48:21,167 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-03-01T17:48:21,168 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,168 616 | for (i = 0; i < num_of_bytes; i++) 2024-03-01T17:48:21,168 | ~~^~~~~~~~~~~~~~ 2024-03-01T17:48:21,169 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,169 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-03-01T17:48:21,169 | ~~^~~~~~~~~~~~~~~~ 2024-03-01T17:48:21,170 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-03-01T17:48:21,171 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:16: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:21,171 664 | if (lastbits < num_of_bits) 2024-03-01T17:48:21,171 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-03-01T17:48:21,174 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-03-01T17:48:21,175 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:21,175 785 | if(size3>xfp->buf1size) 2024-03-01T17:48:21,175 | ~~~~~^~~~~~~~~~~~~~ 2024-03-01T17:48:21,177 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:21,177 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-03-01T17:48:21,181 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:21,181 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,181 935 | if(countmjh >= size3 ) { return -1; } 2024-03-01T17:48:21,182 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:21,182 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,182 938 | if(countmjh >= size3 ) { return -1; } 2024-03-01T17:48:21,182 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:21,183 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,183 945 | if(countmjh >= size3 ) { return -1; } 2024-03-01T17:48:21,183 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:21,183 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,184 948 | if(countmjh >= size3 ) { return -1; } 2024-03-01T17:48:21,184 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:21,184 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,184 951 | if(countmjh >= size3 ) { return -1; } 2024-03-01T17:48:21,184 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:21,185 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:17: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-03-01T17:48:21,186 756 | int smallidx, minidx, maxidx; 2024-03-01T17:48:21,186 | ^~~~~~ 2024-03-01T17:48:21,186 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:25: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-03-01T17:48:21,186 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-03-01T17:48:21,186 | ^~~~~~ 2024-03-01T17:48:21,187 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:6: warning: unused variable ‘errval’ [-Wunused-variable] 2024-03-01T17:48:21,187 763 | int errval=1; 2024-03-01T17:48:21,187 | ^~~~~~ 2024-03-01T17:48:21,189 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-03-01T17:48:21,190 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:21,190 1011 | if(size3>xfp->buf1size) 2024-03-01T17:48:21,190 | ~~~~~^~~~~~~~~~~~~~ 2024-03-01T17:48:21,192 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:29: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,192 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-03-01T17:48:21,192 | ~~~~~~~~^~~~~~~ 2024-03-01T17:48:21,193 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,194 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-03-01T17:48:21,194 | ~~~~~~~~^~~~~~~ 2024-03-01T17:48:21,195 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,195 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-03-01T17:48:21,195 | ~~~~~~~~^~~~~~~ 2024-03-01T17:48:21,197 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,197 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-03-01T17:48:21,197 | ^ 2024-03-01T17:48:21,198 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:21,198 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-03-01T17:48:21,207 | ~~~~~^~~~~~~~~~~~~~ 2024-03-01T17:48:21,209 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:21,209 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-03-01T17:48:21,217 | ~~~~~^~~~~~~~~~~~~~ 2024-03-01T17:48:21,221 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:21,222 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-03-01T17:48:21,222 | ^ 2024-03-01T17:48:21,223 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:21,223 1633 | maxidx = (LASTIDX= num && num_of_bits < 32) 2024-03-01T17:48:46,263 | ~~~~~^~~~~~ 2024-03-01T17:48:46,263 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-03-01T17:48:46,263 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:46,263 505 | while (bytes[num_of_bytes] >= num) 2024-03-01T17:48:46,263 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-03-01T17:48:46,265 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-03-01T17:48:46,265 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,266 614 | if (num_of_bits >= num_of_bytes * 8) 2024-03-01T17:48:46,266 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-03-01T17:48:46,266 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,266 616 | for (i = 0; i < num_of_bytes; i++) 2024-03-01T17:48:46,266 | ~~^~~~~~~~~~~~~~ 2024-03-01T17:48:46,266 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,267 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-03-01T17:48:46,267 | ~~^~~~~~~~~~~~~~~~ 2024-03-01T17:48:46,267 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-03-01T17:48:46,267 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:16: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:46,267 664 | if (lastbits < num_of_bits) 2024-03-01T17:48:46,267 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-03-01T17:48:46,270 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-03-01T17:48:46,271 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:46,271 785 | if(size3>xfp->buf1size) 2024-03-01T17:48:46,271 | ~~~~~^~~~~~~~~~~~~~ 2024-03-01T17:48:46,272 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:46,273 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-03-01T17:48:46,275 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:46,276 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,276 935 | if(countmjh >= size3 ) { return -1; } 2024-03-01T17:48:46,276 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:46,276 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,276 938 | if(countmjh >= size3 ) { return -1; } 2024-03-01T17:48:46,276 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:46,276 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,277 945 | if(countmjh >= size3 ) { return -1; } 2024-03-01T17:48:46,277 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:46,277 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,277 948 | if(countmjh >= size3 ) { return -1; } 2024-03-01T17:48:46,277 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:46,277 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,277 951 | if(countmjh >= size3 ) { return -1; } 2024-03-01T17:48:46,277 | ~~~~~~~~~^~~~~~~~ 2024-03-01T17:48:46,278 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:17: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-03-01T17:48:46,278 756 | int smallidx, minidx, maxidx; 2024-03-01T17:48:46,278 | ^~~~~~ 2024-03-01T17:48:46,278 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:25: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-03-01T17:48:46,278 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-03-01T17:48:46,278 | ^~~~~~ 2024-03-01T17:48:46,278 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:6: warning: unused variable ‘errval’ [-Wunused-variable] 2024-03-01T17:48:46,278 763 | int errval=1; 2024-03-01T17:48:46,279 | ^~~~~~ 2024-03-01T17:48:46,279 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-03-01T17:48:46,279 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:46,280 1011 | if(size3>xfp->buf1size) 2024-03-01T17:48:46,280 | ~~~~~^~~~~~~~~~~~~~ 2024-03-01T17:48:46,281 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:29: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,282 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-03-01T17:48:46,282 | ~~~~~~~~^~~~~~~ 2024-03-01T17:48:46,282 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,282 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-03-01T17:48:46,282 | ~~~~~~~~^~~~~~~ 2024-03-01T17:48:46,283 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,283 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-03-01T17:48:46,283 | ~~~~~~~~^~~~~~~ 2024-03-01T17:48:46,284 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,284 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-03-01T17:48:46,285 | ^ 2024-03-01T17:48:46,285 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:46,285 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-03-01T17:48:46,292 | ~~~~~^~~~~~~~~~~~~~ 2024-03-01T17:48:46,294 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:46,294 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-03-01T17:48:46,299 | ~~~~~^~~~~~~~~~~~~~ 2024-03-01T17:48:46,303 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:48:46,303 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-03-01T17:48:46,303 | ^ 2024-03-01T17:48:46,304 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:48:46,304 1633 | maxidx = (LASTIDX= __pyx_pybuffernd_forces.diminfo[2].shape)) __pyx_t_4 = 2; 2024-03-01T17:49:20,818 | ^ 2024-03-01T17:49:20,825 moleculekit/fileformats/xtc/trr.c:11537:19: warning: ‘__pyx_pybuffernd_forces.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,825 11537 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_forces.diminfo[1].shape)) __pyx_t_4 = 1; 2024-03-01T17:49:20,825 | ^ 2024-03-01T17:49:20,826 moleculekit/fileformats/xtc/trr.c:2491:95: warning: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,826 2491 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-03-01T17:49:20,826 | ^ 2024-03-01T17:49:20,832 moleculekit/fileformats/xtc/trr.c:10073:21: note: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ was declared here 2024-03-01T17:49:20,832 10073 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-03-01T17:49:20,832 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:49:20,838 moleculekit/fileformats/xtc/trr.c:11531:59: warning: ‘__pyx_pybuffernd_forces.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,838 11531 | __pyx_t_28 += __pyx_pybuffernd_forces.diminfo[0].shape; 2024-03-01T17:49:20,838 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-03-01T17:49:20,845 moleculekit/fileformats/xtc/trr.c:11484:19: warning: ‘__pyx_pybuffernd_vel.diminfo[2].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,845 11484 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_vel.diminfo[2].shape)) __pyx_t_4 = 2; 2024-03-01T17:49:20,845 | ^ 2024-03-01T17:49:20,852 moleculekit/fileformats/xtc/trr.c:11480:19: warning: ‘__pyx_pybuffernd_vel.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,852 11480 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_vel.diminfo[1].shape)) __pyx_t_4 = 1; 2024-03-01T17:49:20,852 | ^ 2024-03-01T17:49:20,853 moleculekit/fileformats/xtc/trr.c:2491:95: warning: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,853 2491 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-03-01T17:49:20,853 | ^ 2024-03-01T17:49:20,858 moleculekit/fileformats/xtc/trr.c:10089:21: note: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ was declared here 2024-03-01T17:49:20,859 10089 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-03-01T17:49:20,859 | ^~~~~~~~~~~~~~~~~~~~ 2024-03-01T17:49:20,864 moleculekit/fileformats/xtc/trr.c:11474:56: warning: ‘__pyx_pybuffernd_vel.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,865 11474 | __pyx_t_28 += __pyx_pybuffernd_vel.diminfo[0].shape; 2024-03-01T17:49:20,865 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-03-01T17:49:20,870 moleculekit/fileformats/xtc/trr.c:11873:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,871 11873 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_xyz_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-03-01T17:49:20,871 | ^ 2024-03-01T17:49:20,877 moleculekit/fileformats/xtc/trr.c:11869:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,878 11869 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_xyz_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-03-01T17:49:20,878 | ^ 2024-03-01T17:49:20,884 moleculekit/fileformats/xtc/trr.c:11714:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,885 11714 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_vel_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-03-01T17:49:20,885 | ^ 2024-03-01T17:49:20,891 moleculekit/fileformats/xtc/trr.c:11710:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,892 11710 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_vel_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-03-01T17:49:20,892 | ^ 2024-03-01T17:49:20,897 moleculekit/fileformats/xtc/trr.c:11766:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,898 11766 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_forces_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-03-01T17:49:20,898 | ^ 2024-03-01T17:49:20,905 moleculekit/fileformats/xtc/trr.c:11762:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:20,905 11762 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_forces_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-03-01T17:49:20,905 | ^ 2024-03-01T17:49:27,413 arm-linux-gnueabihf-gcc -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdr_seek.o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile.o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile_trr.o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trr.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/trr.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:49:27,639 building 'moleculekit.dcd' extension 2024-03-01T17:49:27,640 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-03-01T17:49:27,641 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-03-01T17:49:27,642 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/dcd -Imoleculekit/fileformats/dcd/include/ -Imoleculekit/fileformats/dcd/ -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/fileformats/dcd/dcd.c -o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.o 2024-03-01T17:49:28,053 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:49:28,054 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:49:28,054 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:49:28,054 from moleculekit/fileformats/dcd/dcd.c:1221: 2024-03-01T17:49:28,054 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:49:28,054 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:49:28,055 | ^~~~~~~ 2024-03-01T17:49:29,093 In file included from moleculekit/fileformats/dcd/include/dcdplugin.h:1, 2024-03-01T17:49:29,093 from moleculekit/fileformats/dcd/dcd.c:1227: 2024-03-01T17:49:29,093 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-03-01T17:49:29,093 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-03-01T17:49:29,094 | ^~~~~~~~~~~~~ 2024-03-01T17:49:29,094 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-03-01T17:49:29,094 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-03-01T17:49:29,094 | ^~~~~~~~~~~~~~ 2024-03-01T17:49:29,094 moleculekit/fileformats/dcd/include/fastio.h:466:12: warning: ‘fio_write_int32’ defined but not used [-Wunused-function] 2024-03-01T17:49:29,094 466 | static int fio_write_int32(fio_fd fd, int i) { 2024-03-01T17:49:29,095 | ^~~~~~~~~~~~~~~ 2024-03-01T17:49:29,095 moleculekit/fileformats/dcd/include/fastio.h:457:19: warning: ‘fio_ftell’ defined but not used [-Wunused-function] 2024-03-01T17:49:29,095 457 | static fio_size_t fio_ftell(fio_fd fd) { 2024-03-01T17:49:29,095 | ^~~~~~~~~ 2024-03-01T17:49:29,095 moleculekit/fileformats/dcd/include/fastio.h:450:19: warning: ‘fio_fseek’ defined but not used [-Wunused-function] 2024-03-01T17:49:29,095 450 | static fio_size_t fio_fseek(fio_fd fd, fio_size_t offset, int whence) { 2024-03-01T17:49:29,095 | ^~~~~~~~~ 2024-03-01T17:49:29,095 moleculekit/fileformats/dcd/include/fastio.h:415:19: warning: ‘fio_readv’ defined but not used [-Wunused-function] 2024-03-01T17:49:29,096 415 | static fio_size_t fio_readv(fio_fd fd, const fio_iovec * iov, int iovcnt) { 2024-03-01T17:49:29,096 | ^~~~~~~~~ 2024-03-01T17:49:29,096 moleculekit/fileformats/dcd/include/fastio.h:394:12: warning: ‘fio_fclose’ defined but not used [-Wunused-function] 2024-03-01T17:49:29,096 394 | static int fio_fclose(fio_fd fd) { 2024-03-01T17:49:29,096 | ^~~~~~~~~~ 2024-03-01T17:49:29,096 moleculekit/fileformats/dcd/include/fastio.h:366:12: warning: ‘fio_open’ defined but not used [-Wunused-function] 2024-03-01T17:49:29,096 366 | static int fio_open(const char *filename, int mode, fio_fd *fd) { 2024-03-01T17:49:29,096 | ^~~~~~~~ 2024-03-01T17:49:41,753 moleculekit/fileformats/dcd/dcd.c: In function ‘__pyx_pf_11moleculekit_3dcd_17DCDTrajectoryFile_18read’: 2024-03-01T17:49:41,753 moleculekit/fileformats/dcd/dcd.c:1123:40: warning: ‘__pyx_v_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:49:41,754 1123 | #define PyInt_FromLong PyLong_FromLong 2024-03-01T17:49:41,754 | ^~~~~~~~~~~~~~~ 2024-03-01T17:49:41,758 moleculekit/fileformats/dcd/dcd.c:8004:7: note: ‘__pyx_v_i’ was declared here 2024-03-01T17:49:41,758 8004 | int __pyx_v_i; 2024-03-01T17:49:41,758 | ^~~~~~~~~ 2024-03-01T17:49:45,095 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/dcd -Imoleculekit/fileformats/dcd/include/ -Imoleculekit/fileformats/dcd/ -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/fileformats/dcd/src/dcdplugin.c -o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src/dcdplugin.o 2024-03-01T17:49:45,282 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdheader’: 2024-03-01T17:49:45,283 moleculekit/fileformats/dcd/src/dcdplugin.c:150:55: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:49:45,283 150 | else if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-03-01T17:49:45,283 | ^~ 2024-03-01T17:49:45,283 moleculekit/fileformats/dcd/src/dcdplugin.c:173:54: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:49:45,283 173 | if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-03-01T17:49:45,284 | ^~ 2024-03-01T17:49:45,284 moleculekit/fileformats/dcd/src/dcdplugin.c:194:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:49:45,284 194 | if (input_integer[0] != dcdcordmagic) 2024-03-01T17:49:45,284 | ^~ 2024-03-01T17:49:45,287 moleculekit/fileformats/dcd/src/dcdplugin.c:409:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:49:45,287 409 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-03-01T17:49:45,287 | ^~ 2024-03-01T17:49:45,288 moleculekit/fileformats/dcd/src/dcdplugin.c:428:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-03-01T17:49:45,288 428 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-03-01T17:49:45,288 | ^~ 2024-03-01T17:49:45,291 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdstep’: 2024-03-01T17:49:45,292 moleculekit/fileformats/dcd/src/dcdplugin.c:651:23: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:49:45,292 651 | if (tmpbuf[i] != sizeof(float) * N) 2024-03-01T17:49:45,292 | ^~ 2024-03-01T17:49:45,292 moleculekit/fileformats/dcd/src/dcdplugin.c:659:49: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-03-01T17:49:45,292 659 | if ((tmpbuf[2 * i] + tmpbuf[2 * i + 1]) != sizeof(float) * N) 2024-03-01T17:49:45,292 | ^~ 2024-03-01T17:49:45,315 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:55: 2024-03-01T17:49:45,315 At top level: 2024-03-01T17:49:45,315 moleculekit/fileformats/dcd/include/endianswap.h:96:13: warning: ‘swap2_aligned’ defined but not used [-Wunused-function] 2024-03-01T17:49:45,315 96 | static void swap2_aligned(void *v, long ndata) { 2024-03-01T17:49:45,316 | ^~~~~~~~~~~~~ 2024-03-01T17:49:45,316 moleculekit/fileformats/dcd/include/endianswap.h:32:13: warning: ‘swap2_unaligned’ defined but not used [-Wunused-function] 2024-03-01T17:49:45,316 32 | static void swap2_unaligned(void *v, long ndata) { 2024-03-01T17:49:45,316 | ^~~~~~~~~~~~~~~ 2024-03-01T17:49:45,316 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:46: 2024-03-01T17:49:45,316 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-03-01T17:49:45,316 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-03-01T17:49:45,317 | ^~~~~~~~~~~~~ 2024-03-01T17:49:45,317 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-03-01T17:49:45,317 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-03-01T17:49:45,317 | ^~~~~~~~~~~~~~ 2024-03-01T17:49:46,426 arm-linux-gnueabihf-gcc -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src/dcdplugin.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/dcd.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:49:46,574 building 'moleculekit.binpos' extension 2024-03-01T17:49:46,575 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-03-01T17:49:46,576 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-03-01T17:49:46,577 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/binpos -Imoleculekit/fileformats/binpos/include/ -Imoleculekit/fileformats/binpos/ -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/fileformats/binpos/binpos.c -o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.o 2024-03-01T17:49:46,907 In file included from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-03-01T17:49:46,907 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-03-01T17:49:46,907 from /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-03-01T17:49:46,907 from moleculekit/fileformats/binpos/binpos.c:1221: 2024-03-01T17:49:46,907 /tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-03-01T17:49:46,907 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-03-01T17:49:46,908 | ^~~~~~~ 2024-03-01T17:50:00,339 moleculekit/fileformats/binpos/binpos.c: In function ‘__pyx_pw_11moleculekit_6binpos_20BINPOSTrajectoryFile_7_read’: 2024-03-01T17:50:00,343 moleculekit/fileformats/binpos/binpos.c:8027:6: warning: ‘__pyx_v_status’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:50:00,344 8027 | if (__pyx_t_1) { 2024-03-01T17:50:00,344 | ^ 2024-03-01T17:50:00,348 moleculekit/fileformats/binpos/binpos.c:7504:7: note: ‘__pyx_v_status’ was declared here 2024-03-01T17:50:00,348 7504 | int __pyx_v_status; 2024-03-01T17:50:00,348 | ^~~~~~~~~~~~~~ 2024-03-01T17:50:00,348 moleculekit/fileformats/binpos/binpos.c:1123:40: warning: ‘__pyx_v_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-03-01T17:50:00,349 1123 | #define PyInt_FromLong PyLong_FromLong 2024-03-01T17:50:00,349 | ^~~~~~~~~~~~~~~ 2024-03-01T17:50:00,353 moleculekit/fileformats/binpos/binpos.c:7501:7: note: ‘__pyx_v_i’ was declared here 2024-03-01T17:50:00,353 7501 | int __pyx_v_i; 2024-03-01T17:50:00,353 | ^~~~~~~~~ 2024-03-01T17:50:02,690 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/binpos -Imoleculekit/fileformats/binpos/include/ -Imoleculekit/fileformats/binpos/ -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/fileformats/binpos/src/binposplugin.c -o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src/binposplugin.o 2024-03-01T17:50:02,996 arm-linux-gnueabihf-gcc -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src/binposplugin.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/binpos.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:50:03,149 building 'moleculekit.tmalign' extension 2024-03-01T17:50:03,150 creating build/temp.linux-armv7l-cpython-39/moleculekit/tmalign 2024-03-01T17:50:03,151 creating build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-03-01T17:50:03,153 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/tmalign -Imoleculekit/tmalign/include/ -Imoleculekit/tmalign/ -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/tmalign/src/TMAlign.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/src/TMAlign.o -w 2024-03-01T17:50:35,125 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/tmalign -Imoleculekit/tmalign/include/ -Imoleculekit/tmalign/ -I/tmp/pip-build-env-3hj_m8wa/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/tmalign/tmalign_util.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.o -w 2024-03-01T17:50:53,778 In file included from /usr/include/c++/10/vector:72, 2024-03-01T17:50:53,778 from moleculekit/tmalign/tmalign_util.cpp:1245: 2024-03-01T17:50:53,779 /usr/include/c++/10/bits/vector.tcc: In member function ‘void std::vector<_Tp, _Alloc>::_M_realloc_insert(std::vector<_Tp, _Alloc>::iterator, _Args&& ...) [with _Args = {const double&}; _Tp = double; _Alloc = std::allocator]’: 2024-03-01T17:50:53,779 /usr/include/c++/10/bits/vector.tcc:426:7: note: parameter passing for argument of type ‘std::vector::iterator’ changed in GCC 7.1 2024-03-01T17:50:53,779 426 | vector<_Tp, _Alloc>:: 2024-03-01T17:50:53,779 | ^~~~~~~~~~~~~~~~~~~ 2024-03-01T17:50:54,356 In file included from /usr/include/c++/10/vector:67, 2024-03-01T17:50:54,356 from moleculekit/tmalign/tmalign_util.cpp:1245: 2024-03-01T17:50:54,356 /usr/include/c++/10/bits/stl_vector.h: In function ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-03-01T17:50:54,357 /usr/include/c++/10/bits/stl_vector.h:1198:21: note: parameter passing for argument of type ‘__gnu_cxx::__normal_iterator >’ changed in GCC 7.1 2024-03-01T17:50:54,357 1198 | _M_realloc_insert(end(), __x); 2024-03-01T17:50:54,357 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-03-01T17:50:54,357 /usr/include/c++/10/bits/stl_vector.h:1198:21: note: parameter passing for argument of type ‘__gnu_cxx::__normal_iterator >’ changed in GCC 7.1 2024-03-01T17:50:54,357 1198 | _M_realloc_insert(end(), __x); 2024-03-01T17:50:54,358 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-03-01T17:50:54,359 /usr/include/c++/10/bits/stl_vector.h:1198:21: note: parameter passing for argument of type ‘__gnu_cxx::__normal_iterator >’ changed in GCC 7.1 2024-03-01T17:50:54,360 1198 | _M_realloc_insert(end(), __x); 2024-03-01T17:50:54,360 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-03-01T17:50:56,871 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/src/TMAlign.o build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so 2024-03-01T17:50:57,396 UPDATING build/lib.linux-armv7l-cpython-39/moleculekit/_version.py 2024-03-01T17:50:57,396 set build/lib.linux-armv7l-cpython-39/moleculekit/_version.py to '1.8.26' 2024-03-01T17:50:57,396 installing to build/bdist.linux-armv7l/wheel 2024-03-01T17:50:57,397 running install 2024-03-01T17:50:57,422 running install_lib 2024-03-01T17:50:57,431 creating build/bdist.linux-armv7l 2024-03-01T17:50:57,432 creating build/bdist.linux-armv7l/wheel 2024-03-01T17:50:57,437 creating build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:57,442 copying build/lib.linux-armv7l-cpython-39/moleculekit/home.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:57,452 creating build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,454 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/autosegment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,462 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/sequencestructuralalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,471 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/preparation_customres.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,481 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/docking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,484 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/atomtyper.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,488 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/graphalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,490 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/detect.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,494 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/hhblitsprofile.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,497 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,708 creating build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-03-01T17:50:57,715 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools/obabel_cli.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-03-01T17:50:57,727 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-03-01T17:50:57,737 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/voxeldescriptors.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,755 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/moleculechecks.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,769 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/crystalpacking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,777 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/preparation.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,789 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/modelling.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-03-01T17:50:57,803 copying build/lib.linux-armv7l-cpython-39/moleculekit/opm.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:57,817 copying build/lib.linux-armv7l-cpython-39/moleculekit/align.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:57,834 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-03-01T17:50:57,837 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-03-01T17:50:57,919 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-03-01T17:50:57,922 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-03-01T17:50:57,975 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-03-01T17:50:57,985 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-03-01T17:50:57,987 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-03-01T17:50:58,043 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-03-01T17:50:58,054 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-03-01T17:50:58,059 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-03-01T17:50:58,073 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-03-01T17:50:58,130 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-03-01T17:50:58,140 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-03-01T17:50:58,204 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-03-01T17:50:58,264 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/interactions.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-03-01T17:50:58,279 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-03-01T17:50:58,281 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-03-01T17:50:58,338 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-03-01T17:50:58,348 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-03-01T17:50:58,437 creating build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-03-01T17:50:58,442 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-03-01T17:50:58,455 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-03-01T17:50:58,514 copying build/lib.linux-armv7l-cpython-39/moleculekit/pymolgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:58,529 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-03-01T17:50:58,534 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/atomselect.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-03-01T17:50:58,551 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/languageparser.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-03-01T17:50:58,566 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-03-01T17:50:58,577 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/analyze.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-03-01T17:50:58,592 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmdgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:58,606 creating build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-03-01T17:50:58,613 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/yacc.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-03-01T17:50:58,632 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-03-01T17:50:58,641 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/lex.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-03-01T17:50:58,652 copying build/lib.linux-armv7l-cpython-39/moleculekit/writers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:58,659 creating build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-03-01T17:50:58,660 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-03-01T17:50:58,699 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-03-01T17:50:58,702 copying build/lib.linux-armv7l-cpython-39/moleculekit/readers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:58,711 copying build/lib.linux-armv7l-cpython-39/moleculekit/molecule.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:58,718 copying build/lib.linux-armv7l-cpython-39/moleculekit/util.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:58,721 copying build/lib.linux-armv7l-cpython-39/moleculekit/version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:58,723 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:58,726 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-03-01T17:50:58,727 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-03-01T17:50:58,728 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-03-01T17:50:58,752 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-03-01T17:50:58,755 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binposlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-03-01T17:50:58,758 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-03-01T17:50:58,759 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src/binposplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-03-01T17:50:58,765 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-03-01T17:50:58,766 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-03-01T17:50:58,770 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/binposplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-03-01T17:50:58,772 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-03-01T17:50:58,774 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/utils.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-03-01T17:50:58,777 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-03-01T17:50:58,778 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-03-01T17:50:58,782 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcdlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-03-01T17:50:58,784 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-03-01T17:50:58,785 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src/dcdplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-03-01T17:50:58,789 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-03-01T17:50:58,809 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-03-01T17:50:58,810 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-03-01T17:50:58,813 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-03-01T17:50:58,815 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/fastio.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-03-01T17:50:58,817 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/endianswap.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-03-01T17:50:58,820 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/dcdplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-03-01T17:50:58,823 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-03-01T17:50:58,824 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtc.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-03-01T17:50:58,826 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xdrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-03-01T17:50:58,828 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-03-01T17:50:58,830 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtclib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-03-01T17:50:58,833 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-03-01T17:50:58,834 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-03-01T17:50:58,837 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-03-01T17:50:58,839 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-03-01T17:50:58,841 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-03-01T17:50:58,845 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdr_seek.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-03-01T17:50:58,847 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trr.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-03-01T17:50:58,850 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-03-01T17:50:58,875 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-03-01T17:50:58,902 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-03-01T17:50:58,903 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-03-01T17:50:58,905 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-03-01T17:50:58,907 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-03-01T17:50:58,909 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/trr_header.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-03-01T17:50:58,911 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdr_seek.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-03-01T17:50:58,913 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-03-01T17:50:58,914 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-03-01T17:50:58,916 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/netcdf.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-03-01T17:50:58,919 creating build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-03-01T17:50:58,919 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-03-01T17:50:58,921 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-03-01T17:50:58,940 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-03-01T17:50:58,942 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-03-01T17:50:58,943 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxWriterTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-03-01T17:50:58,946 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-03-01T17:50:58,948 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-03-01T17:50:58,950 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxReaderTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-03-01T17:50:58,952 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-03-01T17:50:58,955 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-03-01T17:50:58,956 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxParser.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-03-01T17:50:58,960 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxContainers.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-03-01T17:50:58,964 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-03-01T17:50:58,965 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxReader.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-03-01T17:50:58,969 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-03-01T17:50:58,970 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer/PdbxWriter.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-03-01T17:50:58,972 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-03-01T17:50:58,974 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:58,976 copying build/lib.linux-armv7l-cpython-39/moleculekit/_version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:58,979 creating build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-03-01T17:50:58,980 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-03-01T17:50:58,984 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-03-01T17:50:59,021 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,052 copying build/lib.linux-armv7l-cpython-39/moleculekit/dcd.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,081 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-03-01T17:50:59,083 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-03-01T17:50:59,084 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/test_tools.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-03-01T17:50:59,087 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-03-01T17:50:59,089 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/clustering.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-03-01T17:50:59,091 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/restrainedembed.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-03-01T17:50:59,093 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/test_smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-03-01T17:50:59,095 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-03-01T17:50:59,099 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-03-01T17:50:59,101 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/test_smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-03-01T17:50:59,103 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-03-01T17:50:59,105 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-03-01T17:50:59,107 copying build/lib.linux-armv7l-cpython-39/moleculekit/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,109 copying build/lib.linux-armv7l-cpython-39/moleculekit/config.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,110 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,184 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,225 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,248 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmdviewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,251 copying build/lib.linux-armv7l-cpython-39/moleculekit/binpos.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,271 copying build/lib.linux-armv7l-cpython-39/moleculekit/rcsb.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,273 copying build/lib.linux-armv7l-cpython-39/moleculekit/periodictable.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,276 copying build/lib.linux-armv7l-cpython-39/moleculekit/trr.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,324 copying build/lib.linux-armv7l-cpython-39/moleculekit/logging.ini -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:50:59,328 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-03-01T17:50:59,329 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-03-01T17:50:59,548 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-03-01T17:50:59,599 creating build/bdist.linux-armv7l/wheel/moleculekit/share 2024-03-01T17:50:59,602 creating build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-03-01T17:50:59,603 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect/atomselect.json -> build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-03-01T17:50:59,606 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr 2024-03-01T17:50:59,611 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,613 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ABA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,615 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DPP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,618 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AHP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,620 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,630 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DA2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,640 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,649 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ORM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,655 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/03Y.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,660 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ABA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,667 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ME0.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,675 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AA4.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,902 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,916 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NAL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,930 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TY2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,941 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,949 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/APD.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,957 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PCA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,967 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,983 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HPE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:50:59,998 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,011 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ESC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,022 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0BN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,033 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/FGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,045 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/I2M.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,054 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,061 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4IN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,068 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,076 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,083 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,092 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/D4P.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,100 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,107 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,123 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,137 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2GX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,151 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,159 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,167 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HYP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,178 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,194 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HHK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,416 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BB8.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,419 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,422 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/1MH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,425 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IIL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,428 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TRO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,431 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HOX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,434 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YCM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,437 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,440 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,444 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HQA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,447 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/M3L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,450 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NAL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,453 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,456 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,459 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DPP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,462 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2ML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,465 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TY2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,468 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/5JP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,471 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AHP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,474 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/SEP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,477 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MMO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,480 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ME0.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,483 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GHG.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,486 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0A1.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,489 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,492 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2MR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,494 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0A1.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,496 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,498 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,499 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,501 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GNC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,503 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HHK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,505 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,507 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ONL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,509 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BTK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,511 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ESC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,512 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,514 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,516 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,518 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,520 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,522 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/SEP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,523 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YNM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,525 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/KYN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,527 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2AS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,529 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,531 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,532 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,534 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BB8.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,536 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4IN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,537 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,539 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,541 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,543 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,545 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,548 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,549 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,551 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HOX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,553 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BTK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,555 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YCM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,557 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PRK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,559 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,562 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,564 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MMO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,566 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PRK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,568 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TRO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,570 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,571 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/004.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,573 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,575 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IIL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,577 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AA4.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,579 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,581 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/P1L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,584 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ONL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,586 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,588 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NZC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,590 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2AS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,592 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/APD.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,594 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,596 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/004.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,598 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2MR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,599 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CGU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,601 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,604 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PCA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,606 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YNM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,609 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,611 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/FGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,613 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0AF.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,615 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,617 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,619 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DA2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,620 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,622 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,624 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0AF.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,626 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TPO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,628 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/P1L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,630 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,632 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NZC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,634 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CGU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,636 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,637 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OMX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,639 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,640 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,642 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HYP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,644 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,646 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,647 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/KYN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,649 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/5JP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,651 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,653 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,654 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/1MH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,656 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2ML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,658 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,660 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAB.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,662 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/M3L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,664 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,666 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/I2M.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,668 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ORM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,670 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GHG.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,671 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HPE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,673 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HQA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,675 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,677 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,678 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,680 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GNC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,682 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TPO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,684 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,686 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0BN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,688 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/.gitkeep -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,689 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OMX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,691 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAB.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,692 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/03Y.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,694 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,696 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,697 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/D4P.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,699 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2GX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-03-01T17:51:00,701 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/ALA.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-03-01T17:51:00,704 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/backbone.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-03-01T17:51:00,705 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/opm_sequences.json -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-03-01T17:51:01,040 copying build/lib.linux-armv7l-cpython-39/moleculekit/rdkitintegration.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:51:01,043 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:51:01,079 copying build/lib.linux-armv7l-cpython-39/moleculekit/viewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:51:01,082 creating build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,083 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricdistance.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,087 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricshell.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,094 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricfluctuation.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,099 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsphericalcoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,101 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricrmsd.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,104 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricdihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,107 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metrictmscore.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,110 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsasa.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,113 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,116 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricgyration.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,119 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,122 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsecondarystructure.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,125 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/projection.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,127 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricplumed2.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,130 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metriccoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-03-01T17:51:01,133 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:51:01,163 copying build/lib.linux-armv7l-cpython-39/moleculekit/dihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:51:01,165 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:51:01,206 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmd_wrapper -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:51:01,210 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-03-01T17:51:01,211 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-03-01T17:51:01,244 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-03-01T17:51:01,247 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-03-01T17:51:01,248 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src/TMAlign.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-03-01T17:51:01,253 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-03-01T17:51:01,254 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include/TMAlign.h -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-03-01T17:51:01,257 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalignlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-03-01T17:51:01,259 creating build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-03-01T17:51:01,260 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-03-01T17:51:01,292 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-03-01T17:51:01,295 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-03-01T17:51:01,333 running install_egg_info 2024-03-01T17:51:01,339 Copying moleculekit.egg-info to build/bdist.linux-armv7l/wheel/moleculekit-1.8.26-py3.9.egg-info 2024-03-01T17:51:01,352 running install_scripts 2024-03-01T17:51:01,401 creating build/bdist.linux-armv7l/wheel/moleculekit-1.8.26.dist-info/WHEEL 2024-03-01T17:51:01,404 creating '/tmp/pip-wheel-tnquqshb/.tmp-xt2pverp/moleculekit-1.8.26-cp39-cp39-linux_armv7l.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2024-03-01T17:51:01,407 adding 'moleculekit/__init__.py' 2024-03-01T17:51:01,409 adding 'moleculekit/_version.py' 2024-03-01T17:51:01,410 adding 'moleculekit/align.py' 2024-03-01T17:51:01,719 adding 'moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:01,884 adding 'moleculekit/binpos.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:01,891 adding 'moleculekit/bondguesser.py' 2024-03-01T17:51:02,133 adding 'moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:02,142 adding 'moleculekit/config.py' 2024-03-01T17:51:02,403 adding 'moleculekit/cython_utils.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:02,574 adding 'moleculekit/dcd.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:02,583 adding 'moleculekit/dihedral.py' 2024-03-01T17:51:02,587 adding 'moleculekit/distance.py' 2024-03-01T17:51:02,916 adding 'moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:02,928 adding 'moleculekit/home.py' 2024-03-01T17:51:02,929 adding 'moleculekit/logging.ini' 2024-03-01T17:51:02,943 adding 'moleculekit/molecule.py' 2024-03-01T17:51:03,169 adding 'moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:03,178 adding 'moleculekit/opm.py' 2024-03-01T17:51:03,180 adding 'moleculekit/periodictable.py' 2024-03-01T17:51:03,181 adding 'moleculekit/pymolgraphics.py' 2024-03-01T17:51:03,182 adding 'moleculekit/rcsb.py' 2024-03-01T17:51:03,184 adding 'moleculekit/rdkitintegration.py' 2024-03-01T17:51:03,197 adding 'moleculekit/readers.py' 2024-03-01T17:51:03,803 adding 'moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:04,114 adding 'moleculekit/trr.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:04,126 adding 'moleculekit/util.py' 2024-03-01T17:51:04,128 adding 'moleculekit/version.py' 2024-03-01T17:51:04,129 adding 'moleculekit/viewer.py' 2024-03-01T17:51:04,130 adding 'moleculekit/vmd_wrapper' 2024-03-01T17:51:04,132 adding 'moleculekit/vmdgraphics.py' 2024-03-01T17:51:04,134 adding 'moleculekit/vmdviewer.py' 2024-03-01T17:51:04,386 adding 'moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:04,402 adding 'moleculekit/writers.py' 2024-03-01T17:51:04,672 adding 'moleculekit/xtc.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:04,684 adding 'moleculekit/atomselect/__init__.py' 2024-03-01T17:51:04,686 adding 'moleculekit/atomselect/analyze.py' 2024-03-01T17:51:04,689 adding 'moleculekit/atomselect/atomselect.py' 2024-03-01T17:51:04,695 adding 'moleculekit/atomselect/languageparser.py' 2024-03-01T17:51:04,805 adding 'moleculekit/atomselect_utils/atomselect_utils.cpp' 2024-03-01T17:51:04,820 adding 'moleculekit/atomselect_utils/atomselect_utils.pyx' 2024-03-01T17:51:04,918 adding 'moleculekit/bondguesser_utils/bondguesser_utils.cpp' 2024-03-01T17:51:04,931 adding 'moleculekit/bondguesser_utils/bondguesser_utils.pyx' 2024-03-01T17:51:05,028 adding 'moleculekit/cython_utils/cython_utils.cpp' 2024-03-01T17:51:05,040 adding 'moleculekit/cython_utils/cython_utils.pyx' 2024-03-01T17:51:05,150 adding 'moleculekit/distance_utils/distance_utils.cpp' 2024-03-01T17:51:05,162 adding 'moleculekit/distance_utils/distance_utils.pyx' 2024-03-01T17:51:05,170 adding 'moleculekit/fileformats/__init__.py' 2024-03-01T17:51:05,177 adding 'moleculekit/fileformats/netcdf.py' 2024-03-01T17:51:05,183 adding 'moleculekit/fileformats/utils.py' 2024-03-01T17:51:05,247 adding 'moleculekit/fileformats/binpos/binpos.c' 2024-03-01T17:51:05,256 adding 'moleculekit/fileformats/binpos/binpos.pyx' 2024-03-01T17:51:05,261 adding 'moleculekit/fileformats/binpos/binposlib.pxd' 2024-03-01T17:51:05,268 adding 'moleculekit/fileformats/binpos/include/binposplugin.h' 2024-03-01T17:51:05,273 adding 'moleculekit/fileformats/binpos/include/largefiles.h' 2024-03-01T17:51:05,282 adding 'moleculekit/fileformats/binpos/include/molfile_plugin.h' 2024-03-01T17:51:05,291 adding 'moleculekit/fileformats/binpos/src/binposplugin.c' 2024-03-01T17:51:05,360 adding 'moleculekit/fileformats/dcd/dcd.c' 2024-03-01T17:51:05,370 adding 'moleculekit/fileformats/dcd/dcd.pyx' 2024-03-01T17:51:05,373 adding 'moleculekit/fileformats/dcd/dcdlib.pxd' 2024-03-01T17:51:05,377 adding 'moleculekit/fileformats/dcd/include/dcdplugin.h' 2024-03-01T17:51:05,380 adding 'moleculekit/fileformats/dcd/include/endianswap.h' 2024-03-01T17:51:05,383 adding 'moleculekit/fileformats/dcd/include/fastio.h' 2024-03-01T17:51:05,386 adding 'moleculekit/fileformats/dcd/include/largefiles.h' 2024-03-01T17:51:05,392 adding 'moleculekit/fileformats/dcd/include/molfile_plugin.h' 2024-03-01T17:51:05,403 adding 'moleculekit/fileformats/dcd/src/dcdplugin.c' 2024-03-01T17:51:05,503 adding 'moleculekit/fileformats/xtc/trr.c' 2024-03-01T17:51:05,514 adding 'moleculekit/fileformats/xtc/trr.pyx' 2024-03-01T17:51:05,516 adding 'moleculekit/fileformats/xtc/trrlib.pxd' 2024-03-01T17:51:05,517 adding 'moleculekit/fileformats/xtc/xdrlib.pxd' 2024-03-01T17:51:05,607 adding 'moleculekit/fileformats/xtc/xtc.cpp' 2024-03-01T17:51:05,616 adding 'moleculekit/fileformats/xtc/xtc.pyx' 2024-03-01T17:51:05,619 adding 'moleculekit/fileformats/xtc/xtclib.pxd' 2024-03-01T17:51:05,624 adding 'moleculekit/fileformats/xtc/include/trr_header.h' 2024-03-01T17:51:05,625 adding 'moleculekit/fileformats/xtc/include/xdr_seek.h' 2024-03-01T17:51:05,628 adding 'moleculekit/fileformats/xtc/include/xdrfile.h' 2024-03-01T17:51:05,629 adding 'moleculekit/fileformats/xtc/include/xdrfile_trr.h' 2024-03-01T17:51:05,630 adding 'moleculekit/fileformats/xtc/include/xdrfile_xtc.h' 2024-03-01T17:51:05,631 adding 'moleculekit/fileformats/xtc/include/xtc.h' 2024-03-01T17:51:05,633 adding 'moleculekit/fileformats/xtc/src/xdr_seek.c' 2024-03-01T17:51:05,640 adding 'moleculekit/fileformats/xtc/src/xdrfile.cpp' 2024-03-01T17:51:05,642 adding 'moleculekit/fileformats/xtc/src/xdrfile_trr.c' 2024-03-01T17:51:05,644 adding 'moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp' 2024-03-01T17:51:05,646 adding 'moleculekit/fileformats/xtc/src/xtc.cpp' 2024-03-01T17:51:05,648 adding 'moleculekit/interactions/__init__.py' 2024-03-01T17:51:05,935 adding 'moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:06,204 adding 'moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:06,216 adding 'moleculekit/interactions/interactions.py' 2024-03-01T17:51:06,498 adding 'moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:06,786 adding 'moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so' 2024-03-01T17:51:06,887 adding 'moleculekit/interactions/cationpi/cationpi.cpp' 2024-03-01T17:51:06,900 adding 'moleculekit/interactions/cationpi/cationpi.pyx' 2024-03-01T17:51:06,997 adding 'moleculekit/interactions/hbonds/hbonds.cpp' 2024-03-01T17:51:07,008 adding 'moleculekit/interactions/hbonds/hbonds.pyx' 2024-03-01T17:51:07,109 adding 'moleculekit/interactions/pipi/pipi.cpp' 2024-03-01T17:51:07,122 adding 'moleculekit/interactions/pipi/pipi.pyx' 2024-03-01T17:51:07,218 adding 'moleculekit/interactions/sigmahole/sigmahole.cpp' 2024-03-01T17:51:07,230 adding 'moleculekit/interactions/sigmahole/sigmahole.pyx' 2024-03-01T17:51:07,322 adding 'moleculekit/occupancy_utils/occupancy_utils.cpp' 2024-03-01T17:51:07,333 adding 'moleculekit/occupancy_utils/occupancy_utils.pyx' 2024-03-01T17:51:07,341 adding 'moleculekit/pdbx/__init__.py' 2024-03-01T17:51:07,350 adding 'moleculekit/pdbx/reader/PdbxContainers.py' 2024-03-01T17:51:07,357 adding 'moleculekit/pdbx/reader/PdbxParser.py' 2024-03-01T17:51:07,363 adding 'moleculekit/pdbx/reader/PdbxReader.py' 2024-03-01T17:51:07,367 adding 'moleculekit/pdbx/reader/__init__.py' 2024-03-01T17:51:07,377 adding 'moleculekit/pdbx/tests/PdbxReadWriteTests.py' 2024-03-01T17:51:07,382 adding 'moleculekit/pdbx/tests/PdbxReaderTests.py' 2024-03-01T17:51:07,385 adding 'moleculekit/pdbx/tests/PdbxWriterTests.py' 2024-03-01T17:51:07,387 adding 'moleculekit/pdbx/tests/__init__.py' 2024-03-01T17:51:07,389 adding 'moleculekit/pdbx/writer/PdbxWriter.py' 2024-03-01T17:51:07,390 adding 'moleculekit/pdbx/writer/__init__.py' 2024-03-01T17:51:07,399 adding 'moleculekit/ply/__init__.py' 2024-03-01T17:51:07,858 adding 'moleculekit/ply/lex.py' 2024-03-01T17:51:08,566 adding 'moleculekit/ply/yacc.py' 2024-03-01T17:51:09,088 adding 'moleculekit/projections/__init__.py' 2024-03-01T17:51:09,250 adding 'moleculekit/projections/metriccoordinate.py' 2024-03-01T17:51:09,380 adding 'moleculekit/projections/metricdihedral.py' 2024-03-01T17:51:09,451 adding 'moleculekit/projections/metricdistance.py' 2024-03-01T17:51:09,641 adding 'moleculekit/projections/metricfluctuation.py' 2024-03-01T17:51:09,647 adding 'moleculekit/projections/metricgyration.py' 2024-03-01T17:51:09,658 adding 'moleculekit/projections/metricplumed2.py' 2024-03-01T17:51:09,662 adding 'moleculekit/projections/metricrmsd.py' 2024-03-01T17:51:09,666 adding 'moleculekit/projections/metricsasa.py' 2024-03-01T17:51:09,670 adding 'moleculekit/projections/metricsecondarystructure.py' 2024-03-01T17:51:09,674 adding 'moleculekit/projections/metricshell.py' 2024-03-01T17:51:09,677 adding 'moleculekit/projections/metricsphericalcoordinate.py' 2024-03-01T17:51:09,679 adding 'moleculekit/projections/metrictmscore.py' 2024-03-01T17:51:09,681 adding 'moleculekit/projections/projection.py' 2024-03-01T17:51:09,684 adding 'moleculekit/projections/util.py' 2024-03-01T17:51:09,688 adding 'moleculekit/share/ALA.cif' 2024-03-01T17:51:09,690 adding 'moleculekit/share/backbone.cif' 2024-03-01T17:51:11,032 adding 'moleculekit/share/opm_sequences.json' 2024-03-01T17:51:11,117 adding 'moleculekit/share/atomselect/atomselect.json' 2024-03-01T17:51:11,122 adding 'moleculekit/share/pdb2pqr/residues/.gitkeep' 2024-03-01T17:51:11,123 adding 'moleculekit/share/pdb2pqr/residues/004.dat' 2024-03-01T17:51:11,125 adding 'moleculekit/share/pdb2pqr/residues/004.xml' 2024-03-01T17:51:11,126 adding 'moleculekit/share/pdb2pqr/residues/03Y.dat' 2024-03-01T17:51:11,127 adding 'moleculekit/share/pdb2pqr/residues/03Y.xml' 2024-03-01T17:51:11,128 adding 'moleculekit/share/pdb2pqr/residues/0A1.dat' 2024-03-01T17:51:11,129 adding 'moleculekit/share/pdb2pqr/residues/0A1.xml' 2024-03-01T17:51:11,131 adding 'moleculekit/share/pdb2pqr/residues/0AF.dat' 2024-03-01T17:51:11,132 adding 'moleculekit/share/pdb2pqr/residues/0AF.xml' 2024-03-01T17:51:11,133 adding 'moleculekit/share/pdb2pqr/residues/0BN.dat' 2024-03-01T17:51:11,134 adding 'moleculekit/share/pdb2pqr/residues/0BN.xml' 2024-03-01T17:51:11,135 adding 'moleculekit/share/pdb2pqr/residues/1MH.dat' 2024-03-01T17:51:11,137 adding 'moleculekit/share/pdb2pqr/residues/1MH.xml' 2024-03-01T17:51:11,138 adding 'moleculekit/share/pdb2pqr/residues/2AS.dat' 2024-03-01T17:51:11,139 adding 'moleculekit/share/pdb2pqr/residues/2AS.xml' 2024-03-01T17:51:11,140 adding 'moleculekit/share/pdb2pqr/residues/2GX.dat' 2024-03-01T17:51:11,141 adding 'moleculekit/share/pdb2pqr/residues/2GX.xml' 2024-03-01T17:51:11,143 adding 'moleculekit/share/pdb2pqr/residues/2ML.dat' 2024-03-01T17:51:11,144 adding 'moleculekit/share/pdb2pqr/residues/2ML.xml' 2024-03-01T17:51:11,145 adding 'moleculekit/share/pdb2pqr/residues/2MR.dat' 2024-03-01T17:51:11,146 adding 'moleculekit/share/pdb2pqr/residues/2MR.xml' 2024-03-01T17:51:11,148 adding 'moleculekit/share/pdb2pqr/residues/4IN.dat' 2024-03-01T17:51:11,149 adding 'moleculekit/share/pdb2pqr/residues/4IN.xml' 2024-03-01T17:51:11,150 adding 'moleculekit/share/pdb2pqr/residues/4PH.dat' 2024-03-01T17:51:11,151 adding 'moleculekit/share/pdb2pqr/residues/4PH.xml' 2024-03-01T17:51:11,152 adding 'moleculekit/share/pdb2pqr/residues/4PQ.dat' 2024-03-01T17:51:11,154 adding 'moleculekit/share/pdb2pqr/residues/4PQ.xml' 2024-03-01T17:51:11,155 adding 'moleculekit/share/pdb2pqr/residues/5JP.dat' 2024-03-01T17:51:11,156 adding 'moleculekit/share/pdb2pqr/residues/5JP.xml' 2024-03-01T17:51:11,157 adding 'moleculekit/share/pdb2pqr/residues/AA4.dat' 2024-03-01T17:51:11,159 adding 'moleculekit/share/pdb2pqr/residues/AA4.xml' 2024-03-01T17:51:11,160 adding 'moleculekit/share/pdb2pqr/residues/ABA.dat' 2024-03-01T17:51:11,161 adding 'moleculekit/share/pdb2pqr/residues/ABA.xml' 2024-03-01T17:51:11,162 adding 'moleculekit/share/pdb2pqr/residues/AHP.dat' 2024-03-01T17:51:11,163 adding 'moleculekit/share/pdb2pqr/residues/AHP.xml' 2024-03-01T17:51:11,164 adding 'moleculekit/share/pdb2pqr/residues/ALC.dat' 2024-03-01T17:51:11,166 adding 'moleculekit/share/pdb2pqr/residues/ALC.xml' 2024-03-01T17:51:11,167 adding 'moleculekit/share/pdb2pqr/residues/ALN.dat' 2024-03-01T17:51:11,168 adding 'moleculekit/share/pdb2pqr/residues/ALN.xml' 2024-03-01T17:51:11,169 adding 'moleculekit/share/pdb2pqr/residues/ALY.dat' 2024-03-01T17:51:11,171 adding 'moleculekit/share/pdb2pqr/residues/ALY.xml' 2024-03-01T17:51:11,172 adding 'moleculekit/share/pdb2pqr/residues/APD.dat' 2024-03-01T17:51:11,173 adding 'moleculekit/share/pdb2pqr/residues/APD.xml' 2024-03-01T17:51:11,174 adding 'moleculekit/share/pdb2pqr/residues/BB8.dat' 2024-03-01T17:51:11,175 adding 'moleculekit/share/pdb2pqr/residues/BB8.xml' 2024-03-01T17:51:11,177 adding 'moleculekit/share/pdb2pqr/residues/BCS.dat' 2024-03-01T17:51:11,178 adding 'moleculekit/share/pdb2pqr/residues/BCS.xml' 2024-03-01T17:51:11,179 adding 'moleculekit/share/pdb2pqr/residues/BTK.dat' 2024-03-01T17:51:11,181 adding 'moleculekit/share/pdb2pqr/residues/BTK.xml' 2024-03-01T17:51:11,182 adding 'moleculekit/share/pdb2pqr/residues/CCS.dat' 2024-03-01T17:51:11,183 adding 'moleculekit/share/pdb2pqr/residues/CCS.xml' 2024-03-01T17:51:11,185 adding 'moleculekit/share/pdb2pqr/residues/CGU.dat' 2024-03-01T17:51:11,186 adding 'moleculekit/share/pdb2pqr/residues/CGU.xml' 2024-03-01T17:51:11,187 adding 'moleculekit/share/pdb2pqr/residues/CSA.dat' 2024-03-01T17:51:11,189 adding 'moleculekit/share/pdb2pqr/residues/CSA.xml' 2024-03-01T17:51:11,190 adding 'moleculekit/share/pdb2pqr/residues/CSO.dat' 2024-03-01T17:51:11,191 adding 'moleculekit/share/pdb2pqr/residues/CSO.xml' 2024-03-01T17:51:11,192 adding 'moleculekit/share/pdb2pqr/residues/CSP.dat' 2024-03-01T17:51:11,194 adding 'moleculekit/share/pdb2pqr/residues/CSP.xml' 2024-03-01T17:51:11,195 adding 'moleculekit/share/pdb2pqr/residues/CSS.dat' 2024-03-01T17:51:11,196 adding 'moleculekit/share/pdb2pqr/residues/CSS.xml' 2024-03-01T17:51:11,197 adding 'moleculekit/share/pdb2pqr/residues/D4P.dat' 2024-03-01T17:51:11,198 adding 'moleculekit/share/pdb2pqr/residues/D4P.xml' 2024-03-01T17:51:11,199 adding 'moleculekit/share/pdb2pqr/residues/DA2.dat' 2024-03-01T17:51:11,201 adding 'moleculekit/share/pdb2pqr/residues/DA2.xml' 2024-03-01T17:51:11,202 adding 'moleculekit/share/pdb2pqr/residues/DAB.dat' 2024-03-01T17:51:11,203 adding 'moleculekit/share/pdb2pqr/residues/DAB.xml' 2024-03-01T17:51:11,204 adding 'moleculekit/share/pdb2pqr/residues/DAH.dat' 2024-03-01T17:51:11,206 adding 'moleculekit/share/pdb2pqr/residues/DAH.xml' 2024-03-01T17:51:11,207 adding 'moleculekit/share/pdb2pqr/residues/DPP.dat' 2024-03-01T17:51:11,208 adding 'moleculekit/share/pdb2pqr/residues/DPP.xml' 2024-03-01T17:51:11,209 adding 'moleculekit/share/pdb2pqr/residues/ESC.dat' 2024-03-01T17:51:11,211 adding 'moleculekit/share/pdb2pqr/residues/ESC.xml' 2024-03-01T17:51:11,212 adding 'moleculekit/share/pdb2pqr/residues/FGL.dat' 2024-03-01T17:51:11,213 adding 'moleculekit/share/pdb2pqr/residues/FGL.xml' 2024-03-01T17:51:11,214 adding 'moleculekit/share/pdb2pqr/residues/GHG.dat' 2024-03-01T17:51:11,215 adding 'moleculekit/share/pdb2pqr/residues/GHG.xml' 2024-03-01T17:51:11,217 adding 'moleculekit/share/pdb2pqr/residues/GME.dat' 2024-03-01T17:51:11,218 adding 'moleculekit/share/pdb2pqr/residues/GME.xml' 2024-03-01T17:51:11,219 adding 'moleculekit/share/pdb2pqr/residues/GNC.dat' 2024-03-01T17:51:11,221 adding 'moleculekit/share/pdb2pqr/residues/GNC.xml' 2024-03-01T17:51:11,222 adding 'moleculekit/share/pdb2pqr/residues/HHK.dat' 2024-03-01T17:51:11,223 adding 'moleculekit/share/pdb2pqr/residues/HHK.xml' 2024-03-01T17:51:11,224 adding 'moleculekit/share/pdb2pqr/residues/HLU.dat' 2024-03-01T17:51:11,226 adding 'moleculekit/share/pdb2pqr/residues/HLU.xml' 2024-03-01T17:51:11,227 adding 'moleculekit/share/pdb2pqr/residues/HLX.dat' 2024-03-01T17:51:11,228 adding 'moleculekit/share/pdb2pqr/residues/HLX.xml' 2024-03-01T17:51:11,229 adding 'moleculekit/share/pdb2pqr/residues/HOX.dat' 2024-03-01T17:51:11,231 adding 'moleculekit/share/pdb2pqr/residues/HOX.xml' 2024-03-01T17:51:11,232 adding 'moleculekit/share/pdb2pqr/residues/HPE.dat' 2024-03-01T17:51:11,233 adding 'moleculekit/share/pdb2pqr/residues/HPE.xml' 2024-03-01T17:51:11,234 adding 'moleculekit/share/pdb2pqr/residues/HQA.dat' 2024-03-01T17:51:11,236 adding 'moleculekit/share/pdb2pqr/residues/HQA.xml' 2024-03-01T17:51:11,237 adding 'moleculekit/share/pdb2pqr/residues/HTR.dat' 2024-03-01T17:51:11,238 adding 'moleculekit/share/pdb2pqr/residues/HTR.xml' 2024-03-01T17:51:11,240 adding 'moleculekit/share/pdb2pqr/residues/HYP.dat' 2024-03-01T17:51:11,241 adding 'moleculekit/share/pdb2pqr/residues/HYP.xml' 2024-03-01T17:51:11,242 adding 'moleculekit/share/pdb2pqr/residues/I2M.dat' 2024-03-01T17:51:11,243 adding 'moleculekit/share/pdb2pqr/residues/I2M.xml' 2024-03-01T17:51:11,245 adding 'moleculekit/share/pdb2pqr/residues/IGL.dat' 2024-03-01T17:51:11,246 adding 'moleculekit/share/pdb2pqr/residues/IGL.xml' 2024-03-01T17:51:11,247 adding 'moleculekit/share/pdb2pqr/residues/IIL.dat' 2024-03-01T17:51:11,249 adding 'moleculekit/share/pdb2pqr/residues/IIL.xml' 2024-03-01T17:51:11,250 adding 'moleculekit/share/pdb2pqr/residues/IML.dat' 2024-03-01T17:51:11,251 adding 'moleculekit/share/pdb2pqr/residues/IML.xml' 2024-03-01T17:51:11,252 adding 'moleculekit/share/pdb2pqr/residues/KYN.dat' 2024-03-01T17:51:11,253 adding 'moleculekit/share/pdb2pqr/residues/KYN.xml' 2024-03-01T17:51:11,255 adding 'moleculekit/share/pdb2pqr/residues/LME.dat' 2024-03-01T17:51:11,256 adding 'moleculekit/share/pdb2pqr/residues/LME.xml' 2024-03-01T17:51:11,257 adding 'moleculekit/share/pdb2pqr/residues/LMQ.dat' 2024-03-01T17:51:11,258 adding 'moleculekit/share/pdb2pqr/residues/LMQ.xml' 2024-03-01T17:51:11,260 adding 'moleculekit/share/pdb2pqr/residues/LYZ.dat' 2024-03-01T17:51:11,262 adding 'moleculekit/share/pdb2pqr/residues/LYZ.xml' 2024-03-01T17:51:11,263 adding 'moleculekit/share/pdb2pqr/residues/M3L.dat' 2024-03-01T17:51:11,264 adding 'moleculekit/share/pdb2pqr/residues/M3L.xml' 2024-03-01T17:51:11,265 adding 'moleculekit/share/pdb2pqr/residues/ME0.dat' 2024-03-01T17:51:11,267 adding 'moleculekit/share/pdb2pqr/residues/ME0.xml' 2024-03-01T17:51:11,268 adding 'moleculekit/share/pdb2pqr/residues/MEA.dat' 2024-03-01T17:51:11,269 adding 'moleculekit/share/pdb2pqr/residues/MEA.xml' 2024-03-01T17:51:11,270 adding 'moleculekit/share/pdb2pqr/residues/MEN.dat' 2024-03-01T17:51:11,271 adding 'moleculekit/share/pdb2pqr/residues/MEN.xml' 2024-03-01T17:51:11,272 adding 'moleculekit/share/pdb2pqr/residues/MEQ.dat' 2024-03-01T17:51:11,274 adding 'moleculekit/share/pdb2pqr/residues/MEQ.xml' 2024-03-01T17:51:11,275 adding 'moleculekit/share/pdb2pqr/residues/MLE.dat' 2024-03-01T17:51:11,276 adding 'moleculekit/share/pdb2pqr/residues/MLE.xml' 2024-03-01T17:51:11,277 adding 'moleculekit/share/pdb2pqr/residues/MLY.dat' 2024-03-01T17:51:11,279 adding 'moleculekit/share/pdb2pqr/residues/MLY.xml' 2024-03-01T17:51:11,280 adding 'moleculekit/share/pdb2pqr/residues/MLZ.dat' 2024-03-01T17:51:11,281 adding 'moleculekit/share/pdb2pqr/residues/MLZ.xml' 2024-03-01T17:51:11,282 adding 'moleculekit/share/pdb2pqr/residues/MME.dat' 2024-03-01T17:51:11,284 adding 'moleculekit/share/pdb2pqr/residues/MME.xml' 2024-03-01T17:51:11,285 adding 'moleculekit/share/pdb2pqr/residues/MMO.dat' 2024-03-01T17:51:11,286 adding 'moleculekit/share/pdb2pqr/residues/MMO.xml' 2024-03-01T17:51:11,287 adding 'moleculekit/share/pdb2pqr/residues/MVA.dat' 2024-03-01T17:51:11,289 adding 'moleculekit/share/pdb2pqr/residues/MVA.xml' 2024-03-01T17:51:11,290 adding 'moleculekit/share/pdb2pqr/residues/NAL.dat' 2024-03-01T17:51:11,291 adding 'moleculekit/share/pdb2pqr/residues/NAL.xml' 2024-03-01T17:51:11,292 adding 'moleculekit/share/pdb2pqr/residues/NCY.dat' 2024-03-01T17:51:11,294 adding 'moleculekit/share/pdb2pqr/residues/NCY.xml' 2024-03-01T17:51:11,295 adding 'moleculekit/share/pdb2pqr/residues/NLE.dat' 2024-03-01T17:51:11,296 adding 'moleculekit/share/pdb2pqr/residues/NLE.xml' 2024-03-01T17:51:11,297 adding 'moleculekit/share/pdb2pqr/residues/NVA.dat' 2024-03-01T17:51:11,298 adding 'moleculekit/share/pdb2pqr/residues/NVA.xml' 2024-03-01T17:51:11,300 adding 'moleculekit/share/pdb2pqr/residues/NZC.dat' 2024-03-01T17:51:11,301 adding 'moleculekit/share/pdb2pqr/residues/NZC.xml' 2024-03-01T17:51:11,302 adding 'moleculekit/share/pdb2pqr/residues/OCY.dat' 2024-03-01T17:51:11,303 adding 'moleculekit/share/pdb2pqr/residues/OCY.xml' 2024-03-01T17:51:11,304 adding 'moleculekit/share/pdb2pqr/residues/OMX.dat' 2024-03-01T17:51:11,306 adding 'moleculekit/share/pdb2pqr/residues/OMX.xml' 2024-03-01T17:51:11,307 adding 'moleculekit/share/pdb2pqr/residues/ONL.dat' 2024-03-01T17:51:11,308 adding 'moleculekit/share/pdb2pqr/residues/ONL.xml' 2024-03-01T17:51:11,309 adding 'moleculekit/share/pdb2pqr/residues/ORM.dat' 2024-03-01T17:51:11,310 adding 'moleculekit/share/pdb2pqr/residues/ORM.xml' 2024-03-01T17:51:11,311 adding 'moleculekit/share/pdb2pqr/residues/P1L.dat' 2024-03-01T17:51:11,313 adding 'moleculekit/share/pdb2pqr/residues/P1L.xml' 2024-03-01T17:51:11,314 adding 'moleculekit/share/pdb2pqr/residues/PCA.dat' 2024-03-01T17:51:11,315 adding 'moleculekit/share/pdb2pqr/residues/PCA.xml' 2024-03-01T17:51:11,316 adding 'moleculekit/share/pdb2pqr/residues/PRK.dat' 2024-03-01T17:51:11,318 adding 'moleculekit/share/pdb2pqr/residues/PRK.xml' 2024-03-01T17:51:11,319 adding 'moleculekit/share/pdb2pqr/residues/PTR.dat' 2024-03-01T17:51:11,320 adding 'moleculekit/share/pdb2pqr/residues/PTR.xml' 2024-03-01T17:51:11,321 adding 'moleculekit/share/pdb2pqr/residues/SEP.dat' 2024-03-01T17:51:11,323 adding 'moleculekit/share/pdb2pqr/residues/SEP.xml' 2024-03-01T17:51:11,324 adding 'moleculekit/share/pdb2pqr/residues/TPO.dat' 2024-03-01T17:51:11,325 adding 'moleculekit/share/pdb2pqr/residues/TPO.xml' 2024-03-01T17:51:11,326 adding 'moleculekit/share/pdb2pqr/residues/TRO.dat' 2024-03-01T17:51:11,328 adding 'moleculekit/share/pdb2pqr/residues/TRO.xml' 2024-03-01T17:51:11,329 adding 'moleculekit/share/pdb2pqr/residues/TY2.dat' 2024-03-01T17:51:11,330 adding 'moleculekit/share/pdb2pqr/residues/TY2.xml' 2024-03-01T17:51:11,331 adding 'moleculekit/share/pdb2pqr/residues/TYQ.dat' 2024-03-01T17:51:11,333 adding 'moleculekit/share/pdb2pqr/residues/TYQ.xml' 2024-03-01T17:51:11,334 adding 'moleculekit/share/pdb2pqr/residues/YCM.dat' 2024-03-01T17:51:11,335 adding 'moleculekit/share/pdb2pqr/residues/YCM.xml' 2024-03-01T17:51:11,336 adding 'moleculekit/share/pdb2pqr/residues/YNM.dat' 2024-03-01T17:51:11,337 adding 'moleculekit/share/pdb2pqr/residues/YNM.xml' 2024-03-01T17:51:11,339 adding 'moleculekit/smallmol/__init__.py' 2024-03-01T17:51:11,344 adding 'moleculekit/smallmol/smallmol.py' 2024-03-01T17:51:11,347 adding 'moleculekit/smallmol/smallmollib.py' 2024-03-01T17:51:11,349 adding 'moleculekit/smallmol/test_smallmol.py' 2024-03-01T17:51:11,351 adding 'moleculekit/smallmol/test_smallmollib.py' 2024-03-01T17:51:11,353 adding 'moleculekit/smallmol/util.py' 2024-03-01T17:51:11,355 adding 'moleculekit/smallmol/tools/__init__.py' 2024-03-01T17:51:11,357 adding 'moleculekit/smallmol/tools/clustering.py' 2024-03-01T17:51:11,358 adding 'moleculekit/smallmol/tools/restrainedembed.py' 2024-03-01T17:51:11,359 adding 'moleculekit/smallmol/tools/test_tools.py' 2024-03-01T17:51:11,450 adding 'moleculekit/tmalign/tmalign_util.cpp' 2024-03-01T17:51:11,458 adding 'moleculekit/tmalign/tmalign_util.pyx' 2024-03-01T17:51:11,460 adding 'moleculekit/tmalign/tmalignlib.pxd' 2024-03-01T17:51:11,461 adding 'moleculekit/tmalign/include/TMAlign.h' 2024-03-01T17:51:11,479 adding 'moleculekit/tmalign/src/TMAlign.cpp' 2024-03-01T17:51:11,482 adding 'moleculekit/tools/__init__.py' 2024-03-01T17:51:11,485 adding 'moleculekit/tools/atomtyper.py' 2024-03-01T17:51:11,487 adding 'moleculekit/tools/autosegment.py' 2024-03-01T17:51:11,489 adding 'moleculekit/tools/crystalpacking.py' 2024-03-01T17:51:11,492 adding 'moleculekit/tools/detect.py' 2024-03-01T17:51:11,494 adding 'moleculekit/tools/docking.py' 2024-03-01T17:51:11,496 adding 'moleculekit/tools/graphalignment.py' 2024-03-01T17:51:11,498 adding 'moleculekit/tools/hhblitsprofile.py' 2024-03-01T17:51:11,499 adding 'moleculekit/tools/modelling.py' 2024-03-01T17:51:11,501 adding 'moleculekit/tools/moleculechecks.py' 2024-03-01T17:51:11,507 adding 'moleculekit/tools/preparation.py' 2024-03-01T17:51:11,509 adding 'moleculekit/tools/preparation_customres.py' 2024-03-01T17:51:11,511 adding 'moleculekit/tools/sequencestructuralalignment.py' 2024-03-01T17:51:11,514 adding 'moleculekit/tools/voxeldescriptors.py' 2024-03-01T17:51:11,516 adding 'moleculekit/tools/obabel_tools/__init__.py' 2024-03-01T17:51:11,517 adding 'moleculekit/tools/obabel_tools/obabel_cli.py' 2024-03-01T17:51:11,609 adding 'moleculekit/wrapping/wrapping.cpp' 2024-03-01T17:51:11,618 adding 'moleculekit/wrapping/wrapping.pyx' 2024-03-01T17:51:11,621 adding 'moleculekit-1.8.26.dist-info/LICENSE' 2024-03-01T17:51:11,622 adding 'moleculekit-1.8.26.dist-info/METADATA' 2024-03-01T17:51:11,623 adding 'moleculekit-1.8.26.dist-info/WHEEL' 2024-03-01T17:51:11,624 adding 'moleculekit-1.8.26.dist-info/top_level.txt' 2024-03-01T17:51:11,629 adding 'moleculekit-1.8.26.dist-info/RECORD' 2024-03-01T17:51:11,934 removing build/bdist.linux-armv7l/wheel 2024-03-01T17:51:12,220 Building wheel for moleculekit (pyproject.toml): finished with status 'done' 2024-03-01T17:51:12,825 Created wheel for moleculekit: filename=moleculekit-1.8.26-cp39-cp39-linux_armv7l.whl size=14902535 sha256=383042586b9089491f7fb534cdbcab48294ebddbd0a60b4a87bd929a5a47d553 2024-03-01T17:51:12,826 Stored in directory: /tmp/pip-ephem-wheel-cache-3w8b6k6f/wheels/da/62/f4/f1b2ba93b3260894871a8d207521ad14b85f0617396d85c0ff 2024-03-01T17:51:12,853 Successfully built moleculekit 2024-03-01T17:51:13,671 Removed build tracker: '/tmp/pip-build-tracker-bt64strz'