2024-06-05T15:50:47,435 Created temporary directory: /tmp/pip-build-tracker-zn9uxige 2024-06-05T15:50:47,436 Initialized build tracking at /tmp/pip-build-tracker-zn9uxige 2024-06-05T15:50:47,436 Created build tracker: /tmp/pip-build-tracker-zn9uxige 2024-06-05T15:50:47,437 Entered build tracker: /tmp/pip-build-tracker-zn9uxige 2024-06-05T15:50:47,437 Created temporary directory: /tmp/pip-wheel-a3esy6x6 2024-06-05T15:50:47,441 Created temporary directory: /tmp/pip-ephem-wheel-cache-pg2_ttvo 2024-06-05T15:50:47,466 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-06-05T15:50:47,469 2 location(s) to search for versions of moleculekit: 2024-06-05T15:50:47,469 * https://pypi.org/simple/moleculekit/ 2024-06-05T15:50:47,469 * https://www.piwheels.org/simple/moleculekit/ 2024-06-05T15:50:47,469 Fetching project page and analyzing links: https://pypi.org/simple/moleculekit/ 2024-06-05T15:50:47,470 Getting page https://pypi.org/simple/moleculekit/ 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links for project 'moleculekit': discarding no candidates 2024-06-05T15:50:47,972 Collecting moleculekit==1.8.33 2024-06-05T15:50:47,974 Created temporary directory: /tmp/pip-unpack-pga_hqjy 2024-06-05T15:50:48,017 Downloading moleculekit-1.8.33.tar.gz (6.8 MB) 2024-06-05T15:50:50,621 Added moleculekit==1.8.33 from https://files.pythonhosted.org/packages/2b/34/e2642fe6f54ec67fdba107eb29968217af52f0b6ef1ac69f533164c6584e/moleculekit-1.8.33.tar.gz to build tracker '/tmp/pip-build-tracker-zn9uxige' 2024-06-05T15:50:50,630 Created temporary directory: /tmp/pip-build-env-__t4ei7e 2024-06-05T15:50:50,640 Installing build dependencies: started 2024-06-05T15:50:50,641 Running command pip subprocess to install build dependencies 2024-06-05T15:50:51,836 Using pip 24.0 from /usr/local/lib/python3.9/dist-packages/pip (python 3.9) 2024-06-05T15:50:52,377 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-06-05T15:50:53,928 Collecting setuptools 2024-06-05T15:50:53,945 Using cached https://www.piwheels.org/simple/setuptools/setuptools-70.0.0-py3-none-any.whl (863 kB) 2024-06-05T15:50:55,032 Collecting numpy>=1.18.5 2024-06-05T15:50:55,049 Using cached https://www.piwheels.org/simple/numpy/numpy-1.26.4-cp39-cp39-linux_armv7l.whl (5.6 MB) 2024-06-05T15:50:56,729 Collecting Cython>=0.29.21 2024-06-05T15:50:56,745 Using cached https://www.piwheels.org/simple/cython/Cython-3.0.10-cp39-cp39-linux_armv7l.whl (10.7 MB) 2024-06-05T15:50:57,179 Collecting toml 2024-06-05T15:50:57,200 Using cached https://www.piwheels.org/simple/toml/toml-0.10.2-py2.py3-none-any.whl (16 kB) 2024-06-05T15:50:57,322 Collecting versioneer==0.28 (from versioneer[toml]==0.28) 2024-06-05T15:50:57,335 Downloading https://www.piwheels.org/simple/versioneer/versioneer-0.28-py3-none-any.whl (45 kB) 2024-06-05T15:50:57,357 ━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━ 45.3/45.3 kB 3.2 MB/s eta 0:00:00 2024-06-05T15:50:57,489 Collecting tomli (from versioneer[toml]==0.28) 2024-06-05T15:50:57,506 Using cached https://www.piwheels.org/simple/tomli/tomli-2.0.1-py3-none-any.whl (12 kB) 2024-06-05T15:50:59,329 Installing collected packages: versioneer, tomli, toml, setuptools, numpy, Cython 2024-06-05T15:50:59,366 Creating /tmp/pip-build-env-__t4ei7e/overlay/bin 2024-06-05T15:50:59,369 changing mode of /tmp/pip-build-env-__t4ei7e/overlay/bin/versioneer to 755 2024-06-05T15:51:10,844 changing mode of /tmp/pip-build-env-__t4ei7e/overlay/bin/f2py to 755 2024-06-05T15:51:14,684 changing mode of /tmp/pip-build-env-__t4ei7e/overlay/bin/cygdb to 755 2024-06-05T15:51:14,687 changing mode of /tmp/pip-build-env-__t4ei7e/overlay/bin/cython to 755 2024-06-05T15:51:14,689 changing mode of /tmp/pip-build-env-__t4ei7e/overlay/bin/cythonize to 755 2024-06-05T15:51:14,715 Successfully installed Cython-3.0.10 numpy-1.26.4 setuptools-70.0.0 toml-0.10.2 tomli-2.0.1 versioneer-0.28 2024-06-05T15:51:15,359 Installing build dependencies: finished with status 'done' 2024-06-05T15:51:15,364 Getting requirements to build wheel: started 2024-06-05T15:51:15,365 Running command Getting requirements to build wheel 2024-06-05T15:51:54,133 warning: moleculekit/wrapping/wrapping.pyx:47:4: Unreachable code 2024-06-05T15:52:03,455 Compiling moleculekit/interactions/hbonds/hbonds.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,456 Compiling moleculekit/interactions/pipi/pipi.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,456 Compiling moleculekit/interactions/cationpi/cationpi.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,456 Compiling moleculekit/interactions/sigmahole/sigmahole.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,456 Compiling moleculekit/wrapping/wrapping.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,456 Compiling moleculekit/bondguesser_utils/bondguesser_utils.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,456 Compiling moleculekit/atomselect_utils/atomselect_utils.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,456 Compiling moleculekit/distance_utils/distance_utils.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,457 Compiling moleculekit/occupancy_utils/occupancy_utils.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,457 Compiling moleculekit/cython_utils/cython_utils.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,457 Compiling moleculekit/fileformats/xtc/xtc.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-06-05T15:52:03,457 Compiling moleculekit/fileformats/xtc/trr.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-06-05T15:52:03,457 Compiling moleculekit/fileformats/dcd/dcd.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-06-05T15:52:03,457 Compiling moleculekit/fileformats/binpos/binpos.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-06-05T15:52:03,458 Compiling moleculekit/tmalign/tmalign_util.pyx because it depends on /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T15:52:03,458 [ 1/15] Cythonizing moleculekit/atomselect_utils/atomselect_utils.pyx 2024-06-05T15:52:03,458 [ 2/15] Cythonizing moleculekit/bondguesser_utils/bondguesser_utils.pyx 2024-06-05T15:52:03,458 [ 3/15] Cythonizing moleculekit/cython_utils/cython_utils.pyx 2024-06-05T15:52:03,458 [ 4/15] Cythonizing moleculekit/distance_utils/distance_utils.pyx 2024-06-05T15:52:03,458 [ 5/15] Cythonizing moleculekit/fileformats/dcd/dcd.pyx 2024-06-05T15:52:03,458 [ 6/15] Cythonizing moleculekit/interactions/cationpi/cationpi.pyx 2024-06-05T15:52:03,458 [ 7/15] Cythonizing moleculekit/interactions/hbonds/hbonds.pyx 2024-06-05T15:52:03,459 [ 8/15] Cythonizing moleculekit/interactions/pipi/pipi.pyx 2024-06-05T15:52:03,459 [ 9/15] Cythonizing moleculekit/interactions/sigmahole/sigmahole.pyx 2024-06-05T15:52:03,459 [10/15] Cythonizing moleculekit/occupancy_utils/occupancy_utils.pyx 2024-06-05T15:52:03,459 [11/15] Cythonizing moleculekit/tmalign/tmalign_util.pyx 2024-06-05T15:52:03,459 [12/15] Cythonizing moleculekit/wrapping/wrapping.pyx 2024-06-05T15:52:03,459 [13/15] Cythonizing moleculekit/fileformats/binpos/binpos.pyx 2024-06-05T15:52:03,459 [14/15] Cythonizing moleculekit/fileformats/xtc/trr.pyx 2024-06-05T15:52:03,460 [15/15] Cythonizing moleculekit/fileformats/xtc/xtc.pyx 2024-06-05T15:52:03,771 running egg_info 2024-06-05T15:52:03,777 writing moleculekit.egg-info/PKG-INFO 2024-06-05T15:52:03,782 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-06-05T15:52:03,784 writing requirements to moleculekit.egg-info/requires.txt 2024-06-05T15:52:03,786 writing top-level names to moleculekit.egg-info/top_level.txt 2024-06-05T15:52:03,819 dependency 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directories found matching 'package' 2024-06-05T15:52:04,223 adding license file 'LICENSE' 2024-06-05T15:52:04,242 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-06-05T15:52:05,630 Getting requirements to build wheel: finished with status 'done' 2024-06-05T15:52:05,646 Installing backend dependencies: started 2024-06-05T15:52:05,647 Running command pip subprocess to install backend dependencies 2024-06-05T15:52:06,956 Using pip 24.0 from /usr/local/lib/python3.9/dist-packages/pip (python 3.9) 2024-06-05T15:52:07,538 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-06-05T15:52:07,919 Collecting wheel 2024-06-05T15:52:07,936 Using cached https://www.piwheels.org/simple/wheel/wheel-0.43.0-py3-none-any.whl (65 kB) 2024-06-05T15:52:09,399 Installing collected packages: wheel 2024-06-05T15:52:09,640 Creating /tmp/pip-build-env-__t4ei7e/normal/bin 2024-06-05T15:52:09,642 changing mode of /tmp/pip-build-env-__t4ei7e/normal/bin/wheel to 755 2024-06-05T15:52:09,658 Successfully installed wheel-0.43.0 2024-06-05T15:52:10,046 Installing backend dependencies: finished with status 'done' 2024-06-05T15:52:10,048 Created temporary directory: /tmp/pip-modern-metadata-ob7tjanu 2024-06-05T15:52:10,051 Preparing metadata (pyproject.toml): started 2024-06-05T15:52:10,052 Running command Preparing metadata (pyproject.toml) 2024-06-05T15:52:12,877 running dist_info 2024-06-05T15:52:12,879 creating /tmp/pip-modern-metadata-ob7tjanu/moleculekit.egg-info 2024-06-05T15:52:12,885 writing /tmp/pip-modern-metadata-ob7tjanu/moleculekit.egg-info/PKG-INFO 2024-06-05T15:52:12,890 writing dependency_links to /tmp/pip-modern-metadata-ob7tjanu/moleculekit.egg-info/dependency_links.txt 2024-06-05T15:52:12,892 writing requirements to /tmp/pip-modern-metadata-ob7tjanu/moleculekit.egg-info/requires.txt 2024-06-05T15:52:12,894 writing top-level names to /tmp/pip-modern-metadata-ob7tjanu/moleculekit.egg-info/top_level.txt 2024-06-05T15:52:12,895 writing manifest file '/tmp/pip-modern-metadata-ob7tjanu/moleculekit.egg-info/SOURCES.txt' 2024-06-05T15:52:12,930 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,930 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,930 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,931 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,931 dependency 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manifest: the path must be relative 2024-06-05T15:52:12,934 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,934 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,934 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,934 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,934 dependency 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manifest: the path must be relative 2024-06-05T15:52:12,935 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,935 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,935 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,935 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,935 dependency 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manifest: the path must be relative 2024-06-05T15:52:12,940 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,940 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,940 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,941 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,941 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,941 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,941 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,942 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,942 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,942 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,942 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,942 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:12,950 reading manifest file '/tmp/pip-modern-metadata-ob7tjanu/moleculekit.egg-info/SOURCES.txt' 2024-06-05T15:52:12,952 reading manifest template 'MANIFEST.in' 2024-06-05T15:52:13,287 no previously-included directories found matching 'moleculekit/test-data' 2024-06-05T15:52:13,287 no previously-included directories found matching 'moleculekit/tests' 2024-06-05T15:52:13,288 no previously-included directories found matching 'package' 2024-06-05T15:52:13,288 adding license file 'LICENSE' 2024-06-05T15:52:13,302 writing manifest file '/tmp/pip-modern-metadata-ob7tjanu/moleculekit.egg-info/SOURCES.txt' 2024-06-05T15:52:13,311 creating '/tmp/pip-modern-metadata-ob7tjanu/moleculekit-1.8.33.dist-info' 2024-06-05T15:52:13,513 Preparing metadata (pyproject.toml): finished with status 'done' 2024-06-05T15:52:13,520 Source in /tmp/pip-wheel-a3esy6x6/moleculekit_d71a5b14c6c54cb5874871021840a001 has version 1.8.33, which satisfies requirement moleculekit==1.8.33 from https://files.pythonhosted.org/packages/2b/34/e2642fe6f54ec67fdba107eb29968217af52f0b6ef1ac69f533164c6584e/moleculekit-1.8.33.tar.gz 2024-06-05T15:52:13,521 Removed moleculekit==1.8.33 from https://files.pythonhosted.org/packages/2b/34/e2642fe6f54ec67fdba107eb29968217af52f0b6ef1ac69f533164c6584e/moleculekit-1.8.33.tar.gz from build tracker '/tmp/pip-build-tracker-zn9uxige' 2024-06-05T15:52:13,528 Created temporary directory: /tmp/pip-unpack-fqn1fwn8 2024-06-05T15:52:13,528 Created temporary directory: /tmp/pip-unpack-aqi2w3qk 2024-06-05T15:52:13,537 Building wheels for collected packages: moleculekit 2024-06-05T15:52:13,541 Created temporary directory: /tmp/pip-wheel-u6c7q0cl 2024-06-05T15:52:13,541 Destination directory: /tmp/pip-wheel-u6c7q0cl 2024-06-05T15:52:13,543 Building wheel for moleculekit (pyproject.toml): started 2024-06-05T15:52:13,544 Running command Building wheel for moleculekit (pyproject.toml) 2024-06-05T15:52:15,954 running bdist_wheel 2024-06-05T15:52:15,972 running build 2024-06-05T15:52:15,973 running build_py 2024-06-05T15:52:15,980 creating build 2024-06-05T15:52:15,981 creating build/lib.linux-armv7l-cpython-39 2024-06-05T15:52:15,981 creating build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:15,982 copying moleculekit/periodictable.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:15,985 copying moleculekit/opm.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:15,987 copying moleculekit/readers.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:15,992 copying moleculekit/bondguesser.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:15,994 copying moleculekit/viewer.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:15,996 copying moleculekit/dihedral.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:15,997 copying moleculekit/vmdgraphics.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:15,999 copying moleculekit/config.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,001 copying moleculekit/distance.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,003 copying moleculekit/writers.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,006 copying moleculekit/home.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,008 copying moleculekit/rdkitintegration.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,010 copying moleculekit/_version.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,011 copying moleculekit/version.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,013 copying moleculekit/vmdviewer.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,015 copying moleculekit/rcsb.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,017 copying moleculekit/pymolgraphics.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,019 copying moleculekit/molecule.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,023 copying moleculekit/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,025 copying moleculekit/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,027 copying moleculekit/align.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,030 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-06-05T15:52:16,031 copying moleculekit/fileformats/netcdf.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-06-05T15:52:16,034 copying moleculekit/fileformats/utils.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-06-05T15:52:16,036 copying moleculekit/fileformats/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-06-05T15:52:16,039 creating build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,039 copying moleculekit/projections/projection.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,041 copying moleculekit/projections/metricsasa.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,044 copying moleculekit/projections/metrictmscore.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,046 copying moleculekit/projections/metricshell.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,048 copying moleculekit/projections/metriccoordinate.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,050 copying moleculekit/projections/metricrmsd.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,052 copying moleculekit/projections/metricplumed2.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,055 copying moleculekit/projections/metricgyration.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,057 copying moleculekit/projections/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,058 copying moleculekit/projections/metricdihedral.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,061 copying moleculekit/projections/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,063 copying moleculekit/projections/metricsecondarystructure.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,066 copying moleculekit/projections/metricfluctuation.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,068 copying moleculekit/projections/metricdistance.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,071 copying moleculekit/projections/metricsphericalcoordinate.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-06-05T15:52:16,074 creating build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,075 copying moleculekit/tools/voxeldescriptors.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,077 copying moleculekit/tools/sequencestructuralalignment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,079 copying moleculekit/tools/docking.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,082 copying moleculekit/tools/modelling.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,084 copying moleculekit/tools/moleculechecks.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,086 copying moleculekit/tools/autosegment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,088 copying moleculekit/tools/atomtyper.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,090 copying moleculekit/tools/preparation_customres.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,093 copying moleculekit/tools/graphalignment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,095 copying moleculekit/tools/detect.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,097 copying moleculekit/tools/preparation.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,100 copying moleculekit/tools/crystalpacking.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,103 copying moleculekit/tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,105 copying moleculekit/tools/hhblitsprofile.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-06-05T15:52:16,107 creating build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-06-05T15:52:16,108 copying moleculekit/atomselect/analyze.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-06-05T15:52:16,110 copying moleculekit/atomselect/atomselect.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-06-05T15:52:16,113 copying moleculekit/atomselect/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-06-05T15:52:16,114 copying moleculekit/atomselect/languageparser.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-06-05T15:52:16,117 creating build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-06-05T15:52:16,117 copying moleculekit/ply/yacc.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-06-05T15:52:16,122 copying moleculekit/ply/lex.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-06-05T15:52:16,125 copying moleculekit/ply/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-06-05T15:52:16,127 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-06-05T15:52:16,127 copying moleculekit/interactions/interactions.py -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-06-05T15:52:16,130 copying moleculekit/interactions/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-06-05T15:52:16,133 creating build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-06-05T15:52:16,134 copying moleculekit/smallmol/smallmolcdp.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-06-05T15:52:16,136 copying moleculekit/smallmol/test_smallmollib.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-06-05T15:52:16,138 copying moleculekit/smallmol/test_smallmol.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-06-05T15:52:16,141 copying moleculekit/smallmol/smallmol.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-06-05T15:52:16,144 copying moleculekit/smallmol/smallmollib.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-06-05T15:52:16,147 copying moleculekit/smallmol/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-06-05T15:52:16,149 copying moleculekit/smallmol/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-06-05T15:52:16,152 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx 2024-06-05T15:52:16,153 copying moleculekit/pdbx/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx 2024-06-05T15:52:16,155 creating build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-06-05T15:52:16,156 copying moleculekit/tools/obabel_tools/obabel_cli.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-06-05T15:52:16,158 copying moleculekit/tools/obabel_tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-06-05T15:52:16,161 creating build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-06-05T15:52:16,162 copying moleculekit/smallmol/tools/clustering.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-06-05T15:52:16,165 copying moleculekit/smallmol/tools/restrainedembed.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-06-05T15:52:16,167 copying moleculekit/smallmol/tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-06-05T15:52:16,169 copying moleculekit/smallmol/tools/test_tools.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-06-05T15:52:16,172 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-06-05T15:52:16,173 copying moleculekit/pdbx/reader/PdbxParser.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-06-05T15:52:16,176 copying moleculekit/pdbx/reader/PdbxReader.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-06-05T15:52:16,179 copying moleculekit/pdbx/reader/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-06-05T15:52:16,181 copying moleculekit/pdbx/reader/PdbxContainers.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-06-05T15:52:16,185 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-06-05T15:52:16,186 copying moleculekit/pdbx/writer/PdbxWriter.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-06-05T15:52:16,188 copying moleculekit/pdbx/writer/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-06-05T15:52:16,190 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-06-05T15:52:16,191 copying moleculekit/pdbx/tests/PdbxWriterTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-06-05T15:52:16,194 copying moleculekit/pdbx/tests/PdbxReaderTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-06-05T15:52:16,197 copying moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-06-05T15:52:16,199 copying moleculekit/pdbx/tests/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-06-05T15:52:16,200 running egg_info 2024-06-05T15:52:16,206 writing moleculekit.egg-info/PKG-INFO 2024-06-05T15:52:16,210 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-06-05T15:52:16,211 writing requirements to moleculekit.egg-info/requires.txt 2024-06-05T15:52:16,213 writing top-level names to moleculekit.egg-info/top_level.txt 2024-06-05T15:52:16,234 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,234 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,234 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,234 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,234 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,235 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,235 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,235 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,235 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,235 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,235 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,235 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,235 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,236 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,236 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,236 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,236 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,236 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,236 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,236 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,237 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,237 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,237 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,237 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,237 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,237 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,237 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,238 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,238 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,238 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,238 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,238 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,238 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,238 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,238 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,239 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,239 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,239 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,239 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,239 dependency 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manifest: the path must be relative 2024-06-05T15:52:16,240 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,240 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,240 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,240 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,240 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,240 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,240 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,240 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,241 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,241 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,241 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,241 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,241 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,241 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,241 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,242 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,243 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,243 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,244 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,244 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,244 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,245 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,245 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,245 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,245 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,245 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,246 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,246 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,246 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,246 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,246 dependency /tmp/pip-build-env-__t4ei7e/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 2024-06-05T15:52:16,253 reading manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-06-05T15:52:16,263 reading manifest template 'MANIFEST.in' 2024-06-05T15:52:16,575 no previously-included directories found matching 'moleculekit/test-data' 2024-06-05T15:52:16,576 no previously-included directories found matching 'moleculekit/tests' 2024-06-05T15:52:16,577 no previously-included directories found matching 'package' 2024-06-05T15:52:16,578 adding license file 'LICENSE' 2024-06-05T15:52:16,596 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-06-05T15:52:16,607 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.atomselect_utils' is absent from the `packages` configuration. 2024-06-05T15:52:16,607 !! 2024-06-05T15:52:16,608 ******************************************************************************** 2024-06-05T15:52:16,608 ############################ 2024-06-05T15:52:16,608 # Package would be ignored # 2024-06-05T15:52:16,608 ############################ 2024-06-05T15:52:16,608 Python recognizes 'moleculekit.atomselect_utils' as an importable package[^1], 2024-06-05T15:52:16,608 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,608 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,609 package, please make sure that 'moleculekit.atomselect_utils' is explicitly added 2024-06-05T15:52:16,609 to the `packages` configuration field. 2024-06-05T15:52:16,609 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,609 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,609 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,609 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,610 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,610 If you don't want 'moleculekit.atomselect_utils' to be distributed and are 2024-06-05T15:52:16,610 already explicitly excluding 'moleculekit.atomselect_utils' via 2024-06-05T15:52:16,610 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,610 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,610 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,610 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,611 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,611 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,611 even if it does not contain any `.py` files. 2024-06-05T15:52:16,611 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,611 directory, all directories are treated like packages. 2024-06-05T15:52:16,611 ******************************************************************************** 2024-06-05T15:52:16,612 !! 2024-06-05T15:52:16,612 check.warn(importable) 2024-06-05T15:52:16,612 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.bondguesser_utils' is absent from the `packages` configuration. 2024-06-05T15:52:16,612 !! 2024-06-05T15:52:16,612 ******************************************************************************** 2024-06-05T15:52:16,613 ############################ 2024-06-05T15:52:16,613 # Package would be ignored # 2024-06-05T15:52:16,613 ############################ 2024-06-05T15:52:16,613 Python recognizes 'moleculekit.bondguesser_utils' as an importable package[^1], 2024-06-05T15:52:16,613 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,613 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,613 package, please make sure that 'moleculekit.bondguesser_utils' is explicitly added 2024-06-05T15:52:16,614 to the `packages` configuration field. 2024-06-05T15:52:16,614 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,614 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,614 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,614 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,615 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,615 If you don't want 'moleculekit.bondguesser_utils' to be distributed and are 2024-06-05T15:52:16,615 already explicitly excluding 'moleculekit.bondguesser_utils' via 2024-06-05T15:52:16,615 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,615 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,615 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,616 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,616 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,616 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,616 even if it does not contain any `.py` files. 2024-06-05T15:52:16,616 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,616 directory, all directories are treated like packages. 2024-06-05T15:52:16,617 ******************************************************************************** 2024-06-05T15:52:16,617 !! 2024-06-05T15:52:16,617 check.warn(importable) 2024-06-05T15:52:16,617 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.cython_utils' is absent from the `packages` configuration. 2024-06-05T15:52:16,617 !! 2024-06-05T15:52:16,617 ******************************************************************************** 2024-06-05T15:52:16,617 ############################ 2024-06-05T15:52:16,618 # Package would be ignored # 2024-06-05T15:52:16,618 ############################ 2024-06-05T15:52:16,618 Python recognizes 'moleculekit.cython_utils' as an importable package[^1], 2024-06-05T15:52:16,618 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,618 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,618 package, please make sure that 'moleculekit.cython_utils' is explicitly added 2024-06-05T15:52:16,618 to the `packages` configuration field. 2024-06-05T15:52:16,619 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,619 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,619 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,619 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,619 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,619 If you don't want 'moleculekit.cython_utils' to be distributed and are 2024-06-05T15:52:16,620 already explicitly excluding 'moleculekit.cython_utils' via 2024-06-05T15:52:16,620 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,620 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,620 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,620 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,620 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,621 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,621 even if it does not contain any `.py` files. 2024-06-05T15:52:16,621 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,621 directory, all directories are treated like packages. 2024-06-05T15:52:16,621 ******************************************************************************** 2024-06-05T15:52:16,621 !! 2024-06-05T15:52:16,621 check.warn(importable) 2024-06-05T15:52:16,621 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.distance_utils' is absent from the `packages` configuration. 2024-06-05T15:52:16,621 !! 2024-06-05T15:52:16,622 ******************************************************************************** 2024-06-05T15:52:16,622 ############################ 2024-06-05T15:52:16,622 # Package would be ignored # 2024-06-05T15:52:16,622 ############################ 2024-06-05T15:52:16,622 Python recognizes 'moleculekit.distance_utils' as an importable package[^1], 2024-06-05T15:52:16,622 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,622 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,623 package, please make sure that 'moleculekit.distance_utils' is explicitly added 2024-06-05T15:52:16,623 to the `packages` configuration field. 2024-06-05T15:52:16,623 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,623 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,623 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,623 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,624 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,624 If you don't want 'moleculekit.distance_utils' to be distributed and are 2024-06-05T15:52:16,624 already explicitly excluding 'moleculekit.distance_utils' via 2024-06-05T15:52:16,624 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,624 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,624 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,624 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,625 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,625 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,625 even if it does not contain any `.py` files. 2024-06-05T15:52:16,625 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,625 directory, all directories are treated like packages. 2024-06-05T15:52:16,625 ******************************************************************************** 2024-06-05T15:52:16,625 !! 2024-06-05T15:52:16,626 check.warn(importable) 2024-06-05T15:52:16,626 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos' is absent from the `packages` configuration. 2024-06-05T15:52:16,626 !! 2024-06-05T15:52:16,626 ******************************************************************************** 2024-06-05T15:52:16,626 ############################ 2024-06-05T15:52:16,626 # Package would be ignored # 2024-06-05T15:52:16,626 ############################ 2024-06-05T15:52:16,626 Python recognizes 'moleculekit.fileformats.binpos' as an importable package[^1], 2024-06-05T15:52:16,627 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,627 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,627 package, please make sure that 'moleculekit.fileformats.binpos' is explicitly added 2024-06-05T15:52:16,627 to the `packages` configuration field. 2024-06-05T15:52:16,627 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,627 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,627 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,628 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,628 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,628 If you don't want 'moleculekit.fileformats.binpos' to be distributed and are 2024-06-05T15:52:16,628 already explicitly excluding 'moleculekit.fileformats.binpos' via 2024-06-05T15:52:16,628 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,628 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,628 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,629 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,629 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,629 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,629 even if it does not contain any `.py` files. 2024-06-05T15:52:16,629 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,630 directory, all directories are treated like packages. 2024-06-05T15:52:16,630 ******************************************************************************** 2024-06-05T15:52:16,630 !! 2024-06-05T15:52:16,630 check.warn(importable) 2024-06-05T15:52:16,630 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos.include' is absent from the `packages` configuration. 2024-06-05T15:52:16,630 !! 2024-06-05T15:52:16,630 ******************************************************************************** 2024-06-05T15:52:16,631 ############################ 2024-06-05T15:52:16,631 # Package would be ignored # 2024-06-05T15:52:16,631 ############################ 2024-06-05T15:52:16,631 Python recognizes 'moleculekit.fileformats.binpos.include' as an importable package[^1], 2024-06-05T15:52:16,631 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,631 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,631 package, please make sure that 'moleculekit.fileformats.binpos.include' is explicitly added 2024-06-05T15:52:16,631 to the `packages` configuration field. 2024-06-05T15:52:16,632 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,632 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,632 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,632 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,632 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,633 If you don't want 'moleculekit.fileformats.binpos.include' to be distributed and are 2024-06-05T15:52:16,633 already explicitly excluding 'moleculekit.fileformats.binpos.include' via 2024-06-05T15:52:16,633 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,633 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,633 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,633 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,633 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,634 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,634 even if it does not contain any `.py` files. 2024-06-05T15:52:16,634 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,634 directory, all directories are treated like packages. 2024-06-05T15:52:16,634 ******************************************************************************** 2024-06-05T15:52:16,634 !! 2024-06-05T15:52:16,635 check.warn(importable) 2024-06-05T15:52:16,635 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos.src' is absent from the `packages` configuration. 2024-06-05T15:52:16,635 !! 2024-06-05T15:52:16,635 ******************************************************************************** 2024-06-05T15:52:16,635 ############################ 2024-06-05T15:52:16,635 # Package would be ignored # 2024-06-05T15:52:16,635 ############################ 2024-06-05T15:52:16,635 Python recognizes 'moleculekit.fileformats.binpos.src' as an importable package[^1], 2024-06-05T15:52:16,636 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,636 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,636 package, please make sure that 'moleculekit.fileformats.binpos.src' is explicitly added 2024-06-05T15:52:16,636 to the `packages` configuration field. 2024-06-05T15:52:16,636 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,636 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,636 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,637 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,637 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,637 If you don't want 'moleculekit.fileformats.binpos.src' to be distributed and are 2024-06-05T15:52:16,637 already explicitly excluding 'moleculekit.fileformats.binpos.src' via 2024-06-05T15:52:16,637 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,637 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,638 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,638 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,638 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,638 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,638 even if it does not contain any `.py` files. 2024-06-05T15:52:16,639 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,639 directory, all directories are treated like packages. 2024-06-05T15:52:16,639 ******************************************************************************** 2024-06-05T15:52:16,639 !! 2024-06-05T15:52:16,639 check.warn(importable) 2024-06-05T15:52:16,639 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd' is absent from the `packages` configuration. 2024-06-05T15:52:16,639 !! 2024-06-05T15:52:16,640 ******************************************************************************** 2024-06-05T15:52:16,640 ############################ 2024-06-05T15:52:16,640 # Package would be ignored # 2024-06-05T15:52:16,640 ############################ 2024-06-05T15:52:16,640 Python recognizes 'moleculekit.fileformats.dcd' as an importable package[^1], 2024-06-05T15:52:16,640 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,640 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,640 package, please make sure that 'moleculekit.fileformats.dcd' is explicitly added 2024-06-05T15:52:16,641 to the `packages` configuration field. 2024-06-05T15:52:16,641 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,641 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,641 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,641 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,641 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,642 If you don't want 'moleculekit.fileformats.dcd' to be distributed and are 2024-06-05T15:52:16,642 already explicitly excluding 'moleculekit.fileformats.dcd' via 2024-06-05T15:52:16,642 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,642 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,642 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,642 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,643 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,643 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,643 even if it does not contain any `.py` files. 2024-06-05T15:52:16,643 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,643 directory, all directories are treated like packages. 2024-06-05T15:52:16,643 ******************************************************************************** 2024-06-05T15:52:16,644 !! 2024-06-05T15:52:16,644 check.warn(importable) 2024-06-05T15:52:16,644 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd.include' is absent from the `packages` configuration. 2024-06-05T15:52:16,644 !! 2024-06-05T15:52:16,644 ******************************************************************************** 2024-06-05T15:52:16,644 ############################ 2024-06-05T15:52:16,644 # Package would be ignored # 2024-06-05T15:52:16,644 ############################ 2024-06-05T15:52:16,645 Python recognizes 'moleculekit.fileformats.dcd.include' as an importable package[^1], 2024-06-05T15:52:16,645 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,645 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,645 package, please make sure that 'moleculekit.fileformats.dcd.include' is explicitly added 2024-06-05T15:52:16,645 to the `packages` configuration field. 2024-06-05T15:52:16,645 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,645 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,646 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,646 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,646 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,646 If you don't want 'moleculekit.fileformats.dcd.include' to be distributed and are 2024-06-05T15:52:16,646 already explicitly excluding 'moleculekit.fileformats.dcd.include' via 2024-06-05T15:52:16,646 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,647 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,647 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,647 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,647 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,648 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,648 even if it does not contain any `.py` files. 2024-06-05T15:52:16,648 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,648 directory, all directories are treated like packages. 2024-06-05T15:52:16,648 ******************************************************************************** 2024-06-05T15:52:16,648 !! 2024-06-05T15:52:16,648 check.warn(importable) 2024-06-05T15:52:16,649 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd.src' is absent from the `packages` configuration. 2024-06-05T15:52:16,649 !! 2024-06-05T15:52:16,649 ******************************************************************************** 2024-06-05T15:52:16,649 ############################ 2024-06-05T15:52:16,649 # Package would be ignored # 2024-06-05T15:52:16,649 ############################ 2024-06-05T15:52:16,649 Python recognizes 'moleculekit.fileformats.dcd.src' as an importable package[^1], 2024-06-05T15:52:16,649 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,650 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,650 package, please make sure that 'moleculekit.fileformats.dcd.src' is explicitly added 2024-06-05T15:52:16,650 to the `packages` configuration field. 2024-06-05T15:52:16,650 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,650 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,650 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,650 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,651 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,651 If you don't want 'moleculekit.fileformats.dcd.src' to be distributed and are 2024-06-05T15:52:16,651 already explicitly excluding 'moleculekit.fileformats.dcd.src' via 2024-06-05T15:52:16,651 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,651 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,651 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,652 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,652 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,652 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,652 even if it does not contain any `.py` files. 2024-06-05T15:52:16,652 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,652 directory, all directories are treated like packages. 2024-06-05T15:52:16,653 ******************************************************************************** 2024-06-05T15:52:16,653 !! 2024-06-05T15:52:16,653 check.warn(importable) 2024-06-05T15:52:16,653 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc' is absent from the `packages` configuration. 2024-06-05T15:52:16,653 !! 2024-06-05T15:52:16,653 ******************************************************************************** 2024-06-05T15:52:16,654 ############################ 2024-06-05T15:52:16,654 # Package would be ignored # 2024-06-05T15:52:16,654 ############################ 2024-06-05T15:52:16,654 Python recognizes 'moleculekit.fileformats.xtc' as an importable package[^1], 2024-06-05T15:52:16,654 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,654 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,654 package, please make sure that 'moleculekit.fileformats.xtc' is explicitly added 2024-06-05T15:52:16,654 to the `packages` configuration field. 2024-06-05T15:52:16,655 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,655 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,655 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,655 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,655 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,655 If you don't want 'moleculekit.fileformats.xtc' to be distributed and are 2024-06-05T15:52:16,656 already explicitly excluding 'moleculekit.fileformats.xtc' via 2024-06-05T15:52:16,656 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,656 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,656 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,656 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,656 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,657 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,657 even if it does not contain any `.py` files. 2024-06-05T15:52:16,657 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,657 directory, all directories are treated like packages. 2024-06-05T15:52:16,657 ******************************************************************************** 2024-06-05T15:52:16,657 !! 2024-06-05T15:52:16,657 check.warn(importable) 2024-06-05T15:52:16,658 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc.include' is absent from the `packages` configuration. 2024-06-05T15:52:16,658 !! 2024-06-05T15:52:16,658 ******************************************************************************** 2024-06-05T15:52:16,658 ############################ 2024-06-05T15:52:16,658 # Package would be ignored # 2024-06-05T15:52:16,658 ############################ 2024-06-05T15:52:16,658 Python recognizes 'moleculekit.fileformats.xtc.include' as an importable package[^1], 2024-06-05T15:52:16,658 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,659 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,659 package, please make sure that 'moleculekit.fileformats.xtc.include' is explicitly added 2024-06-05T15:52:16,659 to the `packages` configuration field. 2024-06-05T15:52:16,659 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,659 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,659 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,660 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,660 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,660 If you don't want 'moleculekit.fileformats.xtc.include' to be distributed and are 2024-06-05T15:52:16,660 already explicitly excluding 'moleculekit.fileformats.xtc.include' via 2024-06-05T15:52:16,660 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,660 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,660 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,661 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,661 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,661 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,661 even if it does not contain any `.py` files. 2024-06-05T15:52:16,661 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,662 directory, all directories are treated like packages. 2024-06-05T15:52:16,662 ******************************************************************************** 2024-06-05T15:52:16,662 !! 2024-06-05T15:52:16,662 check.warn(importable) 2024-06-05T15:52:16,662 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc.src' is absent from the `packages` configuration. 2024-06-05T15:52:16,662 !! 2024-06-05T15:52:16,662 ******************************************************************************** 2024-06-05T15:52:16,663 ############################ 2024-06-05T15:52:16,663 # Package would be ignored # 2024-06-05T15:52:16,663 ############################ 2024-06-05T15:52:16,663 Python recognizes 'moleculekit.fileformats.xtc.src' as an importable package[^1], 2024-06-05T15:52:16,663 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,663 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,663 package, please make sure that 'moleculekit.fileformats.xtc.src' is explicitly added 2024-06-05T15:52:16,663 to the `packages` configuration field. 2024-06-05T15:52:16,664 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,664 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,664 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,664 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,665 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,665 If you don't want 'moleculekit.fileformats.xtc.src' to be distributed and are 2024-06-05T15:52:16,665 already explicitly excluding 'moleculekit.fileformats.xtc.src' via 2024-06-05T15:52:16,665 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,665 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,665 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,666 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,666 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,666 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,666 even if it does not contain any `.py` files. 2024-06-05T15:52:16,666 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,667 directory, all directories are treated like packages. 2024-06-05T15:52:16,667 ******************************************************************************** 2024-06-05T15:52:16,667 !! 2024-06-05T15:52:16,667 check.warn(importable) 2024-06-05T15:52:16,667 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.cationpi' is absent from the `packages` configuration. 2024-06-05T15:52:16,667 !! 2024-06-05T15:52:16,668 ******************************************************************************** 2024-06-05T15:52:16,668 ############################ 2024-06-05T15:52:16,668 # Package would be ignored # 2024-06-05T15:52:16,668 ############################ 2024-06-05T15:52:16,668 Python recognizes 'moleculekit.interactions.cationpi' as an importable package[^1], 2024-06-05T15:52:16,668 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,668 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,668 package, please make sure that 'moleculekit.interactions.cationpi' is explicitly added 2024-06-05T15:52:16,669 to the `packages` configuration field. 2024-06-05T15:52:16,669 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,669 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,669 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,669 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,670 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,670 If you don't want 'moleculekit.interactions.cationpi' to be distributed and are 2024-06-05T15:52:16,670 already explicitly excluding 'moleculekit.interactions.cationpi' via 2024-06-05T15:52:16,670 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,670 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,670 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,671 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,671 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,671 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,671 even if it does not contain any `.py` files. 2024-06-05T15:52:16,672 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,672 directory, all directories are treated like packages. 2024-06-05T15:52:16,672 ******************************************************************************** 2024-06-05T15:52:16,672 !! 2024-06-05T15:52:16,672 check.warn(importable) 2024-06-05T15:52:16,672 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.hbonds' is absent from the `packages` configuration. 2024-06-05T15:52:16,672 !! 2024-06-05T15:52:16,673 ******************************************************************************** 2024-06-05T15:52:16,673 ############################ 2024-06-05T15:52:16,673 # Package would be ignored # 2024-06-05T15:52:16,673 ############################ 2024-06-05T15:52:16,673 Python recognizes 'moleculekit.interactions.hbonds' as an importable package[^1], 2024-06-05T15:52:16,673 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,674 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,674 package, please make sure that 'moleculekit.interactions.hbonds' is explicitly added 2024-06-05T15:52:16,674 to the `packages` configuration field. 2024-06-05T15:52:16,674 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,674 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,674 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,674 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,675 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,675 If you don't want 'moleculekit.interactions.hbonds' to be distributed and are 2024-06-05T15:52:16,675 already explicitly excluding 'moleculekit.interactions.hbonds' via 2024-06-05T15:52:16,675 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,675 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,675 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,676 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,676 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,676 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,676 even if it does not contain any `.py` files. 2024-06-05T15:52:16,677 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,677 directory, all directories are treated like packages. 2024-06-05T15:52:16,677 ******************************************************************************** 2024-06-05T15:52:16,677 !! 2024-06-05T15:52:16,677 check.warn(importable) 2024-06-05T15:52:16,677 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.pipi' is absent from the `packages` configuration. 2024-06-05T15:52:16,677 !! 2024-06-05T15:52:16,678 ******************************************************************************** 2024-06-05T15:52:16,678 ############################ 2024-06-05T15:52:16,678 # Package would be ignored # 2024-06-05T15:52:16,678 ############################ 2024-06-05T15:52:16,678 Python recognizes 'moleculekit.interactions.pipi' as an importable package[^1], 2024-06-05T15:52:16,678 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,679 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,679 package, please make sure that 'moleculekit.interactions.pipi' is explicitly added 2024-06-05T15:52:16,679 to the `packages` configuration field. 2024-06-05T15:52:16,679 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,679 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,679 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,679 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,680 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,680 If you don't want 'moleculekit.interactions.pipi' to be distributed and are 2024-06-05T15:52:16,680 already explicitly excluding 'moleculekit.interactions.pipi' via 2024-06-05T15:52:16,680 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,680 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,680 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,681 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,681 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,681 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,681 even if it does not contain any `.py` files. 2024-06-05T15:52:16,681 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,681 directory, all directories are treated like packages. 2024-06-05T15:52:16,682 ******************************************************************************** 2024-06-05T15:52:16,682 !! 2024-06-05T15:52:16,682 check.warn(importable) 2024-06-05T15:52:16,682 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.sigmahole' is absent from the `packages` configuration. 2024-06-05T15:52:16,682 !! 2024-06-05T15:52:16,682 ******************************************************************************** 2024-06-05T15:52:16,682 ############################ 2024-06-05T15:52:16,683 # Package would be ignored # 2024-06-05T15:52:16,683 ############################ 2024-06-05T15:52:16,683 Python recognizes 'moleculekit.interactions.sigmahole' as an importable package[^1], 2024-06-05T15:52:16,683 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,683 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,683 package, please make sure that 'moleculekit.interactions.sigmahole' is explicitly added 2024-06-05T15:52:16,684 to the `packages` configuration field. 2024-06-05T15:52:16,684 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,684 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,684 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,684 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,685 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,685 If you don't want 'moleculekit.interactions.sigmahole' to be distributed and are 2024-06-05T15:52:16,685 already explicitly excluding 'moleculekit.interactions.sigmahole' via 2024-06-05T15:52:16,685 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,686 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,686 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,686 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,686 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,687 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,687 even if it does not contain any `.py` files. 2024-06-05T15:52:16,687 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,687 directory, all directories are treated like packages. 2024-06-05T15:52:16,687 ******************************************************************************** 2024-06-05T15:52:16,688 !! 2024-06-05T15:52:16,688 check.warn(importable) 2024-06-05T15:52:16,688 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.occupancy_utils' is absent from the `packages` configuration. 2024-06-05T15:52:16,688 !! 2024-06-05T15:52:16,688 ******************************************************************************** 2024-06-05T15:52:16,689 ############################ 2024-06-05T15:52:16,689 # Package would be ignored # 2024-06-05T15:52:16,689 ############################ 2024-06-05T15:52:16,689 Python recognizes 'moleculekit.occupancy_utils' as an importable package[^1], 2024-06-05T15:52:16,689 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,690 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,690 package, please make sure that 'moleculekit.occupancy_utils' is explicitly added 2024-06-05T15:52:16,690 to the `packages` configuration field. 2024-06-05T15:52:16,690 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,690 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,690 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,691 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,691 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,691 If you don't want 'moleculekit.occupancy_utils' to be distributed and are 2024-06-05T15:52:16,691 already explicitly excluding 'moleculekit.occupancy_utils' via 2024-06-05T15:52:16,691 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,691 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,692 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,692 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,692 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,693 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,693 even if it does not contain any `.py` files. 2024-06-05T15:52:16,693 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,693 directory, all directories are treated like packages. 2024-06-05T15:52:16,693 ******************************************************************************** 2024-06-05T15:52:16,693 !! 2024-06-05T15:52:16,694 check.warn(importable) 2024-06-05T15:52:16,694 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share' is absent from the `packages` configuration. 2024-06-05T15:52:16,694 !! 2024-06-05T15:52:16,694 ******************************************************************************** 2024-06-05T15:52:16,694 ############################ 2024-06-05T15:52:16,694 # Package would be ignored # 2024-06-05T15:52:16,694 ############################ 2024-06-05T15:52:16,695 Python recognizes 'moleculekit.share' as an importable package[^1], 2024-06-05T15:52:16,695 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,695 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,695 package, please make sure that 'moleculekit.share' is explicitly added 2024-06-05T15:52:16,695 to the `packages` configuration field. 2024-06-05T15:52:16,695 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,696 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,696 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,696 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,696 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,696 If you don't want 'moleculekit.share' to be distributed and are 2024-06-05T15:52:16,696 already explicitly excluding 'moleculekit.share' via 2024-06-05T15:52:16,696 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,697 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,697 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,697 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,697 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,698 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,698 even if it does not contain any `.py` files. 2024-06-05T15:52:16,698 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,698 directory, all directories are treated like packages. 2024-06-05T15:52:16,698 ******************************************************************************** 2024-06-05T15:52:16,698 !! 2024-06-05T15:52:16,698 check.warn(importable) 2024-06-05T15:52:16,699 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share.atomselect' is absent from the `packages` configuration. 2024-06-05T15:52:16,699 !! 2024-06-05T15:52:16,699 ******************************************************************************** 2024-06-05T15:52:16,699 ############################ 2024-06-05T15:52:16,699 # Package would be ignored # 2024-06-05T15:52:16,699 ############################ 2024-06-05T15:52:16,699 Python recognizes 'moleculekit.share.atomselect' as an importable package[^1], 2024-06-05T15:52:16,700 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,700 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,700 package, please make sure that 'moleculekit.share.atomselect' is explicitly added 2024-06-05T15:52:16,700 to the `packages` configuration field. 2024-06-05T15:52:16,700 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,700 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,701 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,701 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,701 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,701 If you don't want 'moleculekit.share.atomselect' to be distributed and are 2024-06-05T15:52:16,701 already explicitly excluding 'moleculekit.share.atomselect' via 2024-06-05T15:52:16,701 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,702 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,702 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,702 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,702 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,702 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,702 even if it does not contain any `.py` files. 2024-06-05T15:52:16,703 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,703 directory, all directories are treated like packages. 2024-06-05T15:52:16,703 ******************************************************************************** 2024-06-05T15:52:16,703 !! 2024-06-05T15:52:16,703 check.warn(importable) 2024-06-05T15:52:16,703 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share.pdb2pqr.residues' is absent from the `packages` configuration. 2024-06-05T15:52:16,703 !! 2024-06-05T15:52:16,704 ******************************************************************************** 2024-06-05T15:52:16,704 ############################ 2024-06-05T15:52:16,704 # Package would be ignored # 2024-06-05T15:52:16,704 ############################ 2024-06-05T15:52:16,704 Python recognizes 'moleculekit.share.pdb2pqr.residues' as an importable package[^1], 2024-06-05T15:52:16,704 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,704 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,705 package, please make sure that 'moleculekit.share.pdb2pqr.residues' is explicitly added 2024-06-05T15:52:16,705 to the `packages` configuration field. 2024-06-05T15:52:16,705 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,705 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,705 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,705 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,705 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,706 If you don't want 'moleculekit.share.pdb2pqr.residues' to be distributed and are 2024-06-05T15:52:16,706 already explicitly excluding 'moleculekit.share.pdb2pqr.residues' via 2024-06-05T15:52:16,706 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,706 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,706 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,706 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,706 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,707 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,707 even if it does not contain any `.py` files. 2024-06-05T15:52:16,707 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,707 directory, all directories are treated like packages. 2024-06-05T15:52:16,707 ******************************************************************************** 2024-06-05T15:52:16,707 !! 2024-06-05T15:52:16,708 check.warn(importable) 2024-06-05T15:52:16,708 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign' is absent from the `packages` configuration. 2024-06-05T15:52:16,708 !! 2024-06-05T15:52:16,708 ******************************************************************************** 2024-06-05T15:52:16,708 ############################ 2024-06-05T15:52:16,708 # Package would be ignored # 2024-06-05T15:52:16,708 ############################ 2024-06-05T15:52:16,708 Python recognizes 'moleculekit.tmalign' as an importable package[^1], 2024-06-05T15:52:16,708 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,709 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,709 package, please make sure that 'moleculekit.tmalign' is explicitly added 2024-06-05T15:52:16,709 to the `packages` configuration field. 2024-06-05T15:52:16,709 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,709 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,709 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,709 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,710 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,710 If you don't want 'moleculekit.tmalign' to be distributed and are 2024-06-05T15:52:16,710 already explicitly excluding 'moleculekit.tmalign' via 2024-06-05T15:52:16,710 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,710 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,710 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,710 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,711 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,711 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,711 even if it does not contain any `.py` files. 2024-06-05T15:52:16,711 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,711 directory, all directories are treated like packages. 2024-06-05T15:52:16,711 ******************************************************************************** 2024-06-05T15:52:16,712 !! 2024-06-05T15:52:16,712 check.warn(importable) 2024-06-05T15:52:16,712 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.include' is absent from the `packages` configuration. 2024-06-05T15:52:16,712 !! 2024-06-05T15:52:16,712 ******************************************************************************** 2024-06-05T15:52:16,712 ############################ 2024-06-05T15:52:16,712 # Package would be ignored # 2024-06-05T15:52:16,712 ############################ 2024-06-05T15:52:16,713 Python recognizes 'moleculekit.tmalign.include' as an importable package[^1], 2024-06-05T15:52:16,713 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,713 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,713 package, please make sure that 'moleculekit.tmalign.include' is explicitly added 2024-06-05T15:52:16,713 to the `packages` configuration field. 2024-06-05T15:52:16,713 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,713 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,713 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,714 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,714 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,714 If you don't want 'moleculekit.tmalign.include' to be distributed and are 2024-06-05T15:52:16,714 already explicitly excluding 'moleculekit.tmalign.include' via 2024-06-05T15:52:16,714 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,714 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,715 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,715 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,715 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,715 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,715 even if it does not contain any `.py` files. 2024-06-05T15:52:16,716 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,716 directory, all directories are treated like packages. 2024-06-05T15:52:16,716 ******************************************************************************** 2024-06-05T15:52:16,716 !! 2024-06-05T15:52:16,716 check.warn(importable) 2024-06-05T15:52:16,716 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.src' is absent from the `packages` configuration. 2024-06-05T15:52:16,716 !! 2024-06-05T15:52:16,717 ******************************************************************************** 2024-06-05T15:52:16,717 ############################ 2024-06-05T15:52:16,717 # Package would be ignored # 2024-06-05T15:52:16,717 ############################ 2024-06-05T15:52:16,717 Python recognizes 'moleculekit.tmalign.src' as an importable package[^1], 2024-06-05T15:52:16,717 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,717 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,717 package, please make sure that 'moleculekit.tmalign.src' is explicitly added 2024-06-05T15:52:16,717 to the `packages` configuration field. 2024-06-05T15:52:16,718 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,718 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,718 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,718 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,718 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,718 If you don't want 'moleculekit.tmalign.src' to be distributed and are 2024-06-05T15:52:16,719 already explicitly excluding 'moleculekit.tmalign.src' via 2024-06-05T15:52:16,719 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,719 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,719 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,719 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,719 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,720 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,720 even if it does not contain any `.py` files. 2024-06-05T15:52:16,720 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,720 directory, all directories are treated like packages. 2024-06-05T15:52:16,720 ******************************************************************************** 2024-06-05T15:52:16,720 !! 2024-06-05T15:52:16,720 check.warn(importable) 2024-06-05T15:52:16,720 /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.wrapping' is absent from the `packages` configuration. 2024-06-05T15:52:16,721 !! 2024-06-05T15:52:16,721 ******************************************************************************** 2024-06-05T15:52:16,721 ############################ 2024-06-05T15:52:16,721 # Package would be ignored # 2024-06-05T15:52:16,721 ############################ 2024-06-05T15:52:16,721 Python recognizes 'moleculekit.wrapping' as an importable package[^1], 2024-06-05T15:52:16,721 but it is absent from setuptools' `packages` configuration. 2024-06-05T15:52:16,722 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T15:52:16,722 package, please make sure that 'moleculekit.wrapping' is explicitly added 2024-06-05T15:52:16,722 to the `packages` configuration field. 2024-06-05T15:52:16,722 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T15:52:16,722 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T15:52:16,722 instead of `find_packages(...)`/`find:`). 2024-06-05T15:52:16,722 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T15:52:16,723 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T15:52:16,723 If you don't want 'moleculekit.wrapping' to be distributed and are 2024-06-05T15:52:16,723 already explicitly excluding 'moleculekit.wrapping' via 2024-06-05T15:52:16,723 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T15:52:16,723 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T15:52:16,723 combination with a more fine grained `package-data` configuration. 2024-06-05T15:52:16,723 You can read more about "package data files" on setuptools documentation page: 2024-06-05T15:52:16,724 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T15:52:16,724 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T15:52:16,724 even if it does not contain any `.py` files. 2024-06-05T15:52:16,724 On the other hand, currently there is no concept of package data 2024-06-05T15:52:16,724 directory, all directories are treated like packages. 2024-06-05T15:52:16,724 ******************************************************************************** 2024-06-05T15:52:16,725 !! 2024-06-05T15:52:16,725 check.warn(importable) 2024-06-05T15:52:16,725 copying moleculekit/logging.ini -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,725 copying moleculekit/vmd_wrapper -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:16,725 creating build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-06-05T15:52:16,725 copying moleculekit/atomselect_utils/atomselect_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-06-05T15:52:16,752 copying moleculekit/atomselect_utils/atomselect_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-06-05T15:52:16,755 creating build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-06-05T15:52:16,756 copying moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-06-05T15:52:16,788 copying moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-06-05T15:52:16,790 creating build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-06-05T15:52:16,791 copying moleculekit/cython_utils/cython_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-06-05T15:52:16,820 copying moleculekit/cython_utils/cython_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-06-05T15:52:16,822 creating build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-06-05T15:52:16,823 copying moleculekit/distance_utils/distance_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-06-05T15:52:16,857 copying moleculekit/distance_utils/distance_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-06-05T15:52:16,860 creating build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-06-05T15:52:16,861 copying moleculekit/occupancy_utils/occupancy_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-06-05T15:52:16,928 copying moleculekit/occupancy_utils/occupancy_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-06-05T15:52:16,930 creating build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-06-05T15:52:16,930 copying moleculekit/share/ALA.cif -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-06-05T15:52:16,934 copying moleculekit/share/backbone.cif -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-06-05T15:52:16,937 copying moleculekit/share/opm_sequences.json -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-06-05T15:52:17,202 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect 2024-06-05T15:52:17,203 copying moleculekit/share/atomselect/atomselect.json -> build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect 2024-06-05T15:52:17,205 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr 2024-06-05T15:52:17,206 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,207 copying moleculekit/share/pdb2pqr/residues/.gitkeep -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,208 copying moleculekit/share/pdb2pqr/residues/004.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,210 copying moleculekit/share/pdb2pqr/residues/004.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,212 copying moleculekit/share/pdb2pqr/residues/03Y.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,214 copying moleculekit/share/pdb2pqr/residues/03Y.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,216 copying moleculekit/share/pdb2pqr/residues/0A1.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,218 copying moleculekit/share/pdb2pqr/residues/0A1.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,220 copying moleculekit/share/pdb2pqr/residues/0AF.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,222 copying moleculekit/share/pdb2pqr/residues/0AF.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,224 copying moleculekit/share/pdb2pqr/residues/0BN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,226 copying moleculekit/share/pdb2pqr/residues/0BN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,228 copying moleculekit/share/pdb2pqr/residues/1MH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,230 copying moleculekit/share/pdb2pqr/residues/1MH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,232 copying moleculekit/share/pdb2pqr/residues/2AS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,233 copying moleculekit/share/pdb2pqr/residues/2AS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,235 copying moleculekit/share/pdb2pqr/residues/2GX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,237 copying moleculekit/share/pdb2pqr/residues/2GX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,239 copying moleculekit/share/pdb2pqr/residues/2ML.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,241 copying moleculekit/share/pdb2pqr/residues/2ML.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,243 copying moleculekit/share/pdb2pqr/residues/2MR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,245 copying moleculekit/share/pdb2pqr/residues/2MR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,248 copying moleculekit/share/pdb2pqr/residues/4IN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,250 copying moleculekit/share/pdb2pqr/residues/4IN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,252 copying moleculekit/share/pdb2pqr/residues/4PH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,253 copying moleculekit/share/pdb2pqr/residues/4PH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,255 copying moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,257 copying moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,259 copying moleculekit/share/pdb2pqr/residues/5JP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,261 copying moleculekit/share/pdb2pqr/residues/5JP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,263 copying moleculekit/share/pdb2pqr/residues/AA4.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,265 copying moleculekit/share/pdb2pqr/residues/AA4.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,267 copying moleculekit/share/pdb2pqr/residues/ABA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,269 copying moleculekit/share/pdb2pqr/residues/ABA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,271 copying moleculekit/share/pdb2pqr/residues/AHP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,274 copying moleculekit/share/pdb2pqr/residues/AHP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,275 copying moleculekit/share/pdb2pqr/residues/ALC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,278 copying moleculekit/share/pdb2pqr/residues/ALC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,280 copying moleculekit/share/pdb2pqr/residues/ALN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,281 copying moleculekit/share/pdb2pqr/residues/ALN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,283 copying moleculekit/share/pdb2pqr/residues/ALY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,285 copying moleculekit/share/pdb2pqr/residues/ALY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,287 copying moleculekit/share/pdb2pqr/residues/APD.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,289 copying moleculekit/share/pdb2pqr/residues/APD.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,291 copying moleculekit/share/pdb2pqr/residues/BB8.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,293 copying moleculekit/share/pdb2pqr/residues/BB8.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,295 copying moleculekit/share/pdb2pqr/residues/BCS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,297 copying moleculekit/share/pdb2pqr/residues/BCS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,299 copying moleculekit/share/pdb2pqr/residues/BTK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,301 copying moleculekit/share/pdb2pqr/residues/BTK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,304 copying moleculekit/share/pdb2pqr/residues/CCS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,306 copying moleculekit/share/pdb2pqr/residues/CCS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,308 copying moleculekit/share/pdb2pqr/residues/CGU.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,309 copying moleculekit/share/pdb2pqr/residues/CGU.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,311 copying moleculekit/share/pdb2pqr/residues/CSA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,313 copying moleculekit/share/pdb2pqr/residues/CSA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,315 copying moleculekit/share/pdb2pqr/residues/CSO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,317 copying moleculekit/share/pdb2pqr/residues/CSO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,320 copying moleculekit/share/pdb2pqr/residues/CSP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,321 copying moleculekit/share/pdb2pqr/residues/CSP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,324 copying moleculekit/share/pdb2pqr/residues/CSS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,325 copying moleculekit/share/pdb2pqr/residues/CSS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,327 copying moleculekit/share/pdb2pqr/residues/D4P.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,329 copying moleculekit/share/pdb2pqr/residues/D4P.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,331 copying moleculekit/share/pdb2pqr/residues/DA2.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,333 copying moleculekit/share/pdb2pqr/residues/DA2.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,335 copying moleculekit/share/pdb2pqr/residues/DAB.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,337 copying moleculekit/share/pdb2pqr/residues/DAB.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,339 copying moleculekit/share/pdb2pqr/residues/DAH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,341 copying moleculekit/share/pdb2pqr/residues/DAH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,343 copying moleculekit/share/pdb2pqr/residues/DPP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,345 copying moleculekit/share/pdb2pqr/residues/DPP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,347 copying moleculekit/share/pdb2pqr/residues/ESC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,349 copying moleculekit/share/pdb2pqr/residues/ESC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,351 copying moleculekit/share/pdb2pqr/residues/FGL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,352 copying moleculekit/share/pdb2pqr/residues/FGL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,354 copying moleculekit/share/pdb2pqr/residues/GHG.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,356 copying moleculekit/share/pdb2pqr/residues/GHG.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,358 copying moleculekit/share/pdb2pqr/residues/GME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,360 copying moleculekit/share/pdb2pqr/residues/GME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,362 copying moleculekit/share/pdb2pqr/residues/GNC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,364 copying moleculekit/share/pdb2pqr/residues/GNC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,366 copying moleculekit/share/pdb2pqr/residues/HHK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,368 copying moleculekit/share/pdb2pqr/residues/HHK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,370 copying moleculekit/share/pdb2pqr/residues/HLU.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,372 copying moleculekit/share/pdb2pqr/residues/HLU.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,374 copying moleculekit/share/pdb2pqr/residues/HLX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,376 copying moleculekit/share/pdb2pqr/residues/HLX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,378 copying moleculekit/share/pdb2pqr/residues/HOX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,380 copying moleculekit/share/pdb2pqr/residues/HOX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,382 copying moleculekit/share/pdb2pqr/residues/HPE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,383 copying moleculekit/share/pdb2pqr/residues/HPE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,386 copying moleculekit/share/pdb2pqr/residues/HQA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,388 copying moleculekit/share/pdb2pqr/residues/HQA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,390 copying moleculekit/share/pdb2pqr/residues/HTR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,392 copying moleculekit/share/pdb2pqr/residues/HTR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,394 copying moleculekit/share/pdb2pqr/residues/HYP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,396 copying moleculekit/share/pdb2pqr/residues/HYP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,398 copying moleculekit/share/pdb2pqr/residues/I2M.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,400 copying moleculekit/share/pdb2pqr/residues/I2M.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,402 copying moleculekit/share/pdb2pqr/residues/IGL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,404 copying moleculekit/share/pdb2pqr/residues/IGL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,406 copying moleculekit/share/pdb2pqr/residues/IIL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,408 copying moleculekit/share/pdb2pqr/residues/IIL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,410 copying moleculekit/share/pdb2pqr/residues/IML.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,412 copying moleculekit/share/pdb2pqr/residues/IML.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,414 copying moleculekit/share/pdb2pqr/residues/KYN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,416 copying moleculekit/share/pdb2pqr/residues/KYN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,418 copying moleculekit/share/pdb2pqr/residues/LME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,419 copying moleculekit/share/pdb2pqr/residues/LME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,422 copying moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,423 copying moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,425 copying moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,427 copying moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,429 copying moleculekit/share/pdb2pqr/residues/M3L.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,431 copying moleculekit/share/pdb2pqr/residues/M3L.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,434 copying moleculekit/share/pdb2pqr/residues/ME0.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,435 copying moleculekit/share/pdb2pqr/residues/ME0.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,437 copying moleculekit/share/pdb2pqr/residues/MEA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,439 copying moleculekit/share/pdb2pqr/residues/MEA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,441 copying moleculekit/share/pdb2pqr/residues/MEN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,443 copying moleculekit/share/pdb2pqr/residues/MEN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,445 copying moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,447 copying moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,449 copying moleculekit/share/pdb2pqr/residues/MLE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,451 copying moleculekit/share/pdb2pqr/residues/MLE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,453 copying moleculekit/share/pdb2pqr/residues/MLY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,455 copying moleculekit/share/pdb2pqr/residues/MLY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,457 copying moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,459 copying moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,461 copying moleculekit/share/pdb2pqr/residues/MME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,462 copying moleculekit/share/pdb2pqr/residues/MME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,464 copying moleculekit/share/pdb2pqr/residues/MMO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,466 copying moleculekit/share/pdb2pqr/residues/MMO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,468 copying moleculekit/share/pdb2pqr/residues/MVA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,470 copying moleculekit/share/pdb2pqr/residues/MVA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,472 copying moleculekit/share/pdb2pqr/residues/NAL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,474 copying moleculekit/share/pdb2pqr/residues/NAL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,476 copying moleculekit/share/pdb2pqr/residues/NCY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,478 copying moleculekit/share/pdb2pqr/residues/NCY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,480 copying moleculekit/share/pdb2pqr/residues/NLE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,482 copying moleculekit/share/pdb2pqr/residues/NLE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,484 copying moleculekit/share/pdb2pqr/residues/NVA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,486 copying moleculekit/share/pdb2pqr/residues/NVA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,488 copying moleculekit/share/pdb2pqr/residues/NZC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,490 copying moleculekit/share/pdb2pqr/residues/NZC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,491 copying moleculekit/share/pdb2pqr/residues/OCY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,493 copying moleculekit/share/pdb2pqr/residues/OCY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,495 copying moleculekit/share/pdb2pqr/residues/OMX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,497 copying moleculekit/share/pdb2pqr/residues/OMX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,499 copying moleculekit/share/pdb2pqr/residues/ONL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,501 copying moleculekit/share/pdb2pqr/residues/ONL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,503 copying moleculekit/share/pdb2pqr/residues/ORM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,505 copying moleculekit/share/pdb2pqr/residues/ORM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,507 copying moleculekit/share/pdb2pqr/residues/P1L.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,509 copying moleculekit/share/pdb2pqr/residues/P1L.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,511 copying moleculekit/share/pdb2pqr/residues/PCA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,513 copying moleculekit/share/pdb2pqr/residues/PCA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,516 copying moleculekit/share/pdb2pqr/residues/PRK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,517 copying moleculekit/share/pdb2pqr/residues/PRK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,520 copying moleculekit/share/pdb2pqr/residues/PTR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,522 copying moleculekit/share/pdb2pqr/residues/PTR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,524 copying moleculekit/share/pdb2pqr/residues/SEP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,526 copying moleculekit/share/pdb2pqr/residues/SEP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,527 copying moleculekit/share/pdb2pqr/residues/TPO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,529 copying moleculekit/share/pdb2pqr/residues/TPO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,531 copying moleculekit/share/pdb2pqr/residues/TRO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,533 copying moleculekit/share/pdb2pqr/residues/TRO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,535 copying moleculekit/share/pdb2pqr/residues/TY2.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,537 copying moleculekit/share/pdb2pqr/residues/TY2.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,539 copying moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,541 copying moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,543 copying moleculekit/share/pdb2pqr/residues/YCM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,545 copying moleculekit/share/pdb2pqr/residues/YCM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,547 copying moleculekit/share/pdb2pqr/residues/YNM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,549 copying moleculekit/share/pdb2pqr/residues/YNM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-06-05T15:52:17,551 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-06-05T15:52:17,552 copying moleculekit/tmalign/tmalign_util.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-06-05T15:52:17,580 copying moleculekit/tmalign/tmalign_util.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-06-05T15:52:17,583 copying moleculekit/tmalign/tmalignlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-06-05T15:52:17,585 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include 2024-06-05T15:52:17,586 copying moleculekit/tmalign/include/TMAlign.h -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include 2024-06-05T15:52:17,589 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-06-05T15:52:17,590 copying moleculekit/tmalign/src/TMAlign.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-06-05T15:52:17,597 creating build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-06-05T15:52:17,599 copying moleculekit/wrapping/wrapping.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-06-05T15:52:17,628 copying moleculekit/wrapping/wrapping.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-06-05T15:52:17,630 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-06-05T15:52:17,631 copying moleculekit/fileformats/binpos/binpos.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-06-05T15:52:17,650 copying moleculekit/fileformats/binpos/binpos.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-06-05T15:52:17,652 copying moleculekit/fileformats/binpos/binposlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-06-05T15:52:17,654 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-06-05T15:52:17,655 copying moleculekit/fileformats/binpos/include/binposplugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-06-05T15:52:17,657 copying moleculekit/fileformats/binpos/include/largefiles.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-06-05T15:52:17,659 copying moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-06-05T15:52:17,662 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-06-05T15:52:17,663 copying moleculekit/fileformats/binpos/src/binposplugin.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-06-05T15:52:17,666 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-06-05T15:52:17,666 copying moleculekit/fileformats/dcd/dcd.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-06-05T15:52:17,688 copying moleculekit/fileformats/dcd/dcd.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-06-05T15:52:17,690 copying moleculekit/fileformats/dcd/dcdlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-06-05T15:52:17,692 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-06-05T15:52:17,693 copying moleculekit/fileformats/dcd/include/dcdplugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-06-05T15:52:17,695 copying moleculekit/fileformats/dcd/include/endianswap.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-06-05T15:52:17,697 copying moleculekit/fileformats/dcd/include/fastio.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-06-05T15:52:17,700 copying moleculekit/fileformats/dcd/include/largefiles.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-06-05T15:52:17,701 copying moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-06-05T15:52:17,705 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-06-05T15:52:17,705 copying moleculekit/fileformats/dcd/src/dcdplugin.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-06-05T15:52:17,709 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-06-05T15:52:17,710 copying moleculekit/fileformats/xtc/trr.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-06-05T15:52:17,735 copying moleculekit/fileformats/xtc/trr.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-06-05T15:52:17,738 copying moleculekit/fileformats/xtc/trrlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-06-05T15:52:17,741 copying moleculekit/fileformats/xtc/xdrlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-06-05T15:52:17,743 copying moleculekit/fileformats/xtc/xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-06-05T15:52:17,773 copying moleculekit/fileformats/xtc/xtc.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-06-05T15:52:17,776 copying moleculekit/fileformats/xtc/xtclib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-06-05T15:52:17,778 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-06-05T15:52:17,779 copying moleculekit/fileformats/xtc/include/trr_header.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-06-05T15:52:17,781 copying moleculekit/fileformats/xtc/include/xdr_seek.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-06-05T15:52:17,783 copying moleculekit/fileformats/xtc/include/xdrfile.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-06-05T15:52:17,787 copying moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-06-05T15:52:17,789 copying moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-06-05T15:52:17,791 copying moleculekit/fileformats/xtc/include/xtc.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-06-05T15:52:17,794 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-06-05T15:52:17,795 copying moleculekit/fileformats/xtc/src/xdr_seek.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-06-05T15:52:17,798 copying moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-06-05T15:52:17,802 copying moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-06-05T15:52:17,805 copying moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-06-05T15:52:17,807 copying moleculekit/fileformats/xtc/src/xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-06-05T15:52:17,810 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-06-05T15:52:17,811 copying moleculekit/interactions/cationpi/cationpi.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-06-05T15:52:17,839 copying moleculekit/interactions/cationpi/cationpi.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-06-05T15:52:17,842 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-06-05T15:52:17,843 copying moleculekit/interactions/hbonds/hbonds.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-06-05T15:52:17,870 copying moleculekit/interactions/hbonds/hbonds.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-06-05T15:52:17,874 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-06-05T15:52:17,875 copying moleculekit/interactions/pipi/pipi.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-06-05T15:52:17,905 copying moleculekit/interactions/pipi/pipi.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-06-05T15:52:17,908 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-06-05T15:52:17,909 copying moleculekit/interactions/sigmahole/sigmahole.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-06-05T15:52:17,937 copying moleculekit/interactions/sigmahole/sigmahole.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-06-05T15:52:17,951 UPDATING build/lib.linux-armv7l-cpython-39/moleculekit/_version.py 2024-06-05T15:52:17,951 set build/lib.linux-armv7l-cpython-39/moleculekit/_version.py to '1.8.33' 2024-06-05T15:52:17,951 running build_ext 2024-06-05T15:52:17,966 building 'moleculekit.interactions.hbonds' extension 2024-06-05T15:52:17,966 creating build/temp.linux-armv7l-cpython-39 2024-06-05T15:52:17,967 creating build/temp.linux-armv7l-cpython-39/moleculekit 2024-06-05T15:52:17,968 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions 2024-06-05T15:52:17,969 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-06-05T15:52:17,970 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-__t4ei7e/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 2024-06-05T15:52:18,238 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:52:18,238 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:52:18,238 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:52:18,238 from moleculekit/interactions/hbonds/hbonds.cpp:1265: 2024-06-05T15:52:18,238 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:52:18,239 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:52:18,239 | ^~~~~~~ 2024-06-05T15:52:41,354 moleculekit/interactions/hbonds/hbonds.cpp: In function ‘PyObject* __pyx_pw_11moleculekit_12interactions_6hbonds_1calculate(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-06-05T15:52:41,354 moleculekit/interactions/hbonds/hbonds.cpp:21019:52: warning: ‘__pyx_v_d_idx_h’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:52:41,355 21019 | (__pyx_v_results[__pyx_v_f]).push_back(__pyx_v_d_idx_h); 2024-06-05T15:52:41,355 | ^~~~~~~~~~~~~~~ 2024-06-05T15:52:41,355 moleculekit/interactions/hbonds/hbonds.cpp:20032:57: note: ‘__pyx_v_d_idx_h’ was declared here 2024-06-05T15:52:41,355 20032 | __pyx_t_11moleculekit_12interactions_6hbonds_UINT32_t __pyx_v_d_idx_h; 2024-06-05T15:52:41,355 | ^~~~~~~~~~~~~~~ 2024-06-05T15:52:44,681 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 2024-06-05T15:52:45,008 building 'moleculekit.interactions.pipi' extension 2024-06-05T15:52:45,008 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-06-05T15:52:45,009 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-__t4ei7e/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 2024-06-05T15:52:45,242 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:52:45,242 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:52:45,242 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:52:45,242 from moleculekit/interactions/pipi/pipi.cpp:1265: 2024-06-05T15:52:45,242 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:52:45,242 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:52:45,243 | ^~~~~~~ 2024-06-05T15:53:13,991 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 2024-06-05T15:53:14,322 building 'moleculekit.interactions.cationpi' extension 2024-06-05T15:53:14,322 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-06-05T15:53:14,323 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-__t4ei7e/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 2024-06-05T15:53:14,626 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:53:14,626 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:53:14,626 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:53:14,627 from moleculekit/interactions/cationpi/cationpi.cpp:1265: 2024-06-05T15:53:14,627 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:53:14,627 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:53:14,627 | ^~~~~~~ 2024-06-05T15:53:42,869 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 2024-06-05T15:53:43,198 building 'moleculekit.interactions.sigmahole' extension 2024-06-05T15:53:43,199 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-06-05T15:53:43,199 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-__t4ei7e/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 2024-06-05T15:53:43,489 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:53:43,489 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:53:43,489 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:53:43,489 from moleculekit/interactions/sigmahole/sigmahole.cpp:1265: 2024-06-05T15:53:43,489 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:53:43,490 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:53:43,490 | ^~~~~~~ 2024-06-05T15:54:10,998 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 2024-06-05T15:54:11,338 building 'moleculekit.wrapping' extension 2024-06-05T15:54:11,338 creating build/temp.linux-armv7l-cpython-39/moleculekit/wrapping 2024-06-05T15:54:11,339 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-__t4ei7e/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 2024-06-05T15:54:11,595 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:54:11,595 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:54:11,595 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:54:11,595 from moleculekit/wrapping/wrapping.cpp:1265: 2024-06-05T15:54:11,595 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:54:11,595 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:54:11,595 | ^~~~~~~ 2024-06-05T15:54:37,595 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 2024-06-05T15:54:37,818 building 'moleculekit.bondguesser_utils' extension 2024-06-05T15:54:37,818 creating build/temp.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-06-05T15:54:37,819 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-__t4ei7e/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 2024-06-05T15:54:38,052 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:54:38,052 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:54:38,052 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:54:38,052 from moleculekit/bondguesser_utils/bondguesser_utils.cpp:1265: 2024-06-05T15:54:38,052 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:54:38,053 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:54:38,053 | ^~~~~~~ 2024-06-05T15:54:39,589 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)’: 2024-06-05T15:54:39,590 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19801:33: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-06-05T15:54:39,590 19801 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-06-05T15:54:39,590 | ~~~~~~~~~~^~~~~~~~~~~ 2024-06-05T15:54:39,590 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19813:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-06-05T15:54:39,590 19813 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-06-05T15:54:39,590 | ~~~~~~~~~~^~~~~~~~~~~ 2024-06-05T15:54:39,590 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19825:37: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-06-05T15:54:39,591 19825 | for (__pyx_t_9 = 0; __pyx_t_9 < __pyx_t_8; __pyx_t_9+=1) { 2024-06-05T15:54:39,591 | ~~~~~~~~~~^~~~~~~~~~~ 2024-06-05T15:54:39,591 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19864:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,591 19864 | __pyx_t_12 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T15:54:39,591 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,591 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19903:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,592 19903 | __pyx_t_12 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-06-05T15:54:39,592 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,592 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19942:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,592 19942 | __pyx_t_12 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T15:54:39,592 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,592 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19981:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,592 19981 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T15:54:39,593 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,593 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19987:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,593 19987 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-06-05T15:54:39,593 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,593 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20028:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,593 20028 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T15:54:39,594 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,594 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20034:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,594 20034 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T15:54:39,594 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,594 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20075:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,594 20075 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-06-05T15:54:39,594 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,595 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20081:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,595 20081 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T15:54:39,595 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,595 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20122:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,595 20122 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T15:54:39,595 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,595 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20175:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,596 20175 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T15:54:39,596 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,596 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20222:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,596 20222 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T15:54:39,596 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,596 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20263:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,596 20263 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T15:54:39,597 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,597 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20269:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,597 20269 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-06-05T15:54:39,597 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,597 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20275:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,597 20275 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T15:54:39,597 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,598 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20322:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,598 20322 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-06-05T15:54:39,598 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,598 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20328:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,598 20328 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T15:54:39,598 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,598 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20369:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,599 20369 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T15:54:39,599 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,599 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20381:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,599 20381 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T15:54:39,599 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,599 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20434:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T15:54:39,599 20434 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T15:54:39,600 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,618 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)’: 2024-06-05T15:54:39,619 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21056:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T15:54:39,619 21056 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_n_boxes); 2024-06-05T15:54:39,619 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~ 2024-06-05T15:54:39,619 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21093:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T15:54:39,619 21093 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_boxidx); 2024-06-05T15:54:39,619 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-06-05T15:55:02,816 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 2024-06-05T15:55:03,125 building 'moleculekit.atomselect_utils' extension 2024-06-05T15:55:03,126 creating build/temp.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-06-05T15:55:03,127 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-__t4ei7e/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 2024-06-05T15:55:03,367 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:55:03,367 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:55:03,367 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:55:03,367 from moleculekit/atomselect_utils/atomselect_utils.cpp:1282: 2024-06-05T15:55:03,367 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:55:03,367 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:55:03,367 | ^~~~~~~ 2024-06-05T15:55:05,087 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 >&)’: 2024-06-05T15:55:05,087 moleculekit/atomselect_utils/atomselect_utils.cpp:23255:161: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T15:55:05,087 23255 | __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); 2024-06-05T15:55:05,087 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-06-05T15:55:05,093 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 >&)’: 2024-06-05T15:55:05,093 moleculekit/atomselect_utils/atomselect_utils.cpp:23507:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T15:55:05,093 23507 | __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); 2024-06-05T15:55:05,093 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-06-05T15:55:05,099 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 >&)’: 2024-06-05T15:55:05,099 moleculekit/atomselect_utils/atomselect_utils.cpp:23774:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T15:55:05,099 23774 | __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); 2024-06-05T15:55:05,100 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-06-05T15:55:35,668 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 2024-06-05T15:55:36,003 building 'moleculekit.distance_utils' extension 2024-06-05T15:55:36,004 creating build/temp.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-06-05T15:55:36,005 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-__t4ei7e/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 2024-06-05T15:55:36,245 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:55:36,245 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:55:36,245 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:55:36,245 from moleculekit/distance_utils/distance_utils.cpp:1265: 2024-06-05T15:55:36,245 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:55:36,245 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:55:36,246 | ^~~~~~~ 2024-06-05T15:55:37,918 moleculekit/distance_utils/distance_utils.cpp: In function ‘PyObject* __pyx_pf_11moleculekit_14distance_utils_2get_collisions(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, float)’: 2024-06-05T15:55:37,918 moleculekit/distance_utils/distance_utils.cpp:21359:33: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_14distance_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T15:55:37,918 21359 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-06-05T15:55:37,918 | ~~~~~~~~~~^~~~~~~~~~~ 2024-06-05T15:55:37,918 moleculekit/distance_utils/distance_utils.cpp:21371:35: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_14distance_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T15:55:37,919 21371 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-06-05T15:55:37,919 | ~~~~~~~~~~^~~~~~~~~~~ 2024-06-05T15:56:11,115 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 2024-06-05T15:56:11,548 building 'moleculekit.occupancy_utils' extension 2024-06-05T15:56:11,549 creating build/temp.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-06-05T15:56:11,550 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-__t4ei7e/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 2024-06-05T15:56:11,797 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:56:11,797 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:56:11,797 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:56:11,797 from moleculekit/occupancy_utils/occupancy_utils.cpp:1265: 2024-06-05T15:56:11,797 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:56:11,798 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:56:11,798 | ^~~~~~~ 2024-06-05T15:56:34,821 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so 2024-06-05T15:56:35,057 building 'moleculekit.cython_utils' extension 2024-06-05T15:56:35,058 creating build/temp.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-06-05T15:56:35,059 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-__t4ei7e/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 2024-06-05T15:56:35,292 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:56:35,293 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:56:35,293 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:56:35,293 from moleculekit/cython_utils/cython_utils.cpp:1265: 2024-06-05T15:56:35,293 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:56:35,293 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:56:35,293 | ^~~~~~~ 2024-06-05T15:57:00,856 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 2024-06-05T15:57:01,449 building 'moleculekit.xtc' extension 2024-06-05T15:57:01,449 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats 2024-06-05T15:57:01,450 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-06-05T15:57:01,451 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-06-05T15:57:01,452 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-__t4ei7e/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 2024-06-05T15:57:01,710 moleculekit/fileformats/xtc/src/xdrfile.cpp:66:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,710 66 | "OK", 2024-06-05T15:57:01,710 | ^~~~ 2024-06-05T15:57:01,710 moleculekit/fileformats/xtc/src/xdrfile.cpp:67:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,711 67 | "Header", 2024-06-05T15:57:01,711 | ^~~~~~~~ 2024-06-05T15:57:01,711 moleculekit/fileformats/xtc/src/xdrfile.cpp:68:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,711 68 | "String", 2024-06-05T15:57:01,711 | ^~~~~~~~ 2024-06-05T15:57:01,711 moleculekit/fileformats/xtc/src/xdrfile.cpp:69:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,712 69 | "Double", 2024-06-05T15:57:01,712 | ^~~~~~~~ 2024-06-05T15:57:01,712 moleculekit/fileformats/xtc/src/xdrfile.cpp:70:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,712 70 | "Integer", 2024-06-05T15:57:01,712 | ^~~~~~~~~ 2024-06-05T15:57:01,712 moleculekit/fileformats/xtc/src/xdrfile.cpp:71:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,713 71 | "Float", 2024-06-05T15:57:01,713 | ^~~~~~~ 2024-06-05T15:57:01,713 moleculekit/fileformats/xtc/src/xdrfile.cpp:72:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,713 72 | "Unsigned integer", 2024-06-05T15:57:01,713 | ^~~~~~~~~~~~~~~~~~ 2024-06-05T15:57:01,713 moleculekit/fileformats/xtc/src/xdrfile.cpp:73:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,714 73 | "Compressed 3D coordinate", 2024-06-05T15:57:01,714 | ^~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:57:01,714 moleculekit/fileformats/xtc/src/xdrfile.cpp:74:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,714 74 | "Closing file", 2024-06-05T15:57:01,714 | ^~~~~~~~~~~~~~ 2024-06-05T15:57:01,714 moleculekit/fileformats/xtc/src/xdrfile.cpp:75:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,715 75 | "Magic number", 2024-06-05T15:57:01,715 | ^~~~~~~~~~~~~~ 2024-06-05T15:57:01,715 moleculekit/fileformats/xtc/src/xdrfile.cpp:76:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,715 76 | "Not enough memory", 2024-06-05T15:57:01,715 | ^~~~~~~~~~~~~~~~~~~ 2024-06-05T15:57:01,715 moleculekit/fileformats/xtc/src/xdrfile.cpp:77:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,716 77 | "End of file", 2024-06-05T15:57:01,716 | ^~~~~~~~~~~~~ 2024-06-05T15:57:01,716 moleculekit/fileformats/xtc/src/xdrfile.cpp:78:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T15:57:01,716 78 | "File not found" 2024-06-05T15:57:01,716 | ^~~~~~~~~~~~~~~~ 2024-06-05T15:57:01,724 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofint(int)’: 2024-06-05T15:57:01,725 moleculekit/fileformats/xtc/src/xdrfile.cpp:459:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,725 459 | while (size >= num && num_of_bits < 32) 2024-06-05T15:57:01,725 | ~~~~~^~~~~~ 2024-06-05T15:57:01,726 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-06-05T15:57:01,726 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:01,726 505 | while (bytes[num_of_bytes] >= num) 2024-06-05T15:57:01,726 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-06-05T15:57:01,729 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-06-05T15:57:01,729 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,729 614 | if (num_of_bits >= num_of_bytes * 8) 2024-06-05T15:57:01,729 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-06-05T15:57:01,730 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,730 616 | for (i = 0; i < num_of_bytes; i++) 2024-06-05T15:57:01,730 | ~~^~~~~~~~~~~~~~ 2024-06-05T15:57:01,731 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,731 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-06-05T15:57:01,731 | ~~^~~~~~~~~~~~~~~~ 2024-06-05T15:57:01,732 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-06-05T15:57:01,733 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:16: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:01,733 664 | if (lastbits < num_of_bits) 2024-06-05T15:57:01,733 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-06-05T15:57:01,736 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-06-05T15:57:01,737 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:01,737 785 | if(size3>xfp->buf1size) 2024-06-05T15:57:01,737 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T15:57:01,739 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:01,739 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-06-05T15:57:01,743 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:01,743 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,743 935 | if(countmjh >= size3 ) { return -1; } 2024-06-05T15:57:01,743 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:01,744 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,744 938 | if(countmjh >= size3 ) { return -1; } 2024-06-05T15:57:01,744 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:01,745 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,745 945 | if(countmjh >= size3 ) { return -1; } 2024-06-05T15:57:01,745 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:01,745 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,746 948 | if(countmjh >= size3 ) { return -1; } 2024-06-05T15:57:01,746 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:01,746 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,746 951 | if(countmjh >= size3 ) { return -1; } 2024-06-05T15:57:01,746 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:01,747 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:17: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-06-05T15:57:01,748 756 | int smallidx, minidx, maxidx; 2024-06-05T15:57:01,748 | ^~~~~~ 2024-06-05T15:57:01,748 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:25: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-06-05T15:57:01,748 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-06-05T15:57:01,748 | ^~~~~~ 2024-06-05T15:57:01,748 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:6: warning: unused variable ‘errval’ [-Wunused-variable] 2024-06-05T15:57:01,748 763 | int errval=1; 2024-06-05T15:57:01,749 | ^~~~~~ 2024-06-05T15:57:01,751 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-06-05T15:57:01,751 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:01,752 1011 | if(size3>xfp->buf1size) 2024-06-05T15:57:01,752 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T15:57:01,754 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:29: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,754 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T15:57:01,754 | ~~~~~~~~^~~~~~~ 2024-06-05T15:57:01,755 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,755 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T15:57:01,756 | ~~~~~~~~^~~~~~~ 2024-06-05T15:57:01,756 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,757 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T15:57:01,757 | ~~~~~~~~^~~~~~~ 2024-06-05T15:57:01,759 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,759 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-06-05T15:57:01,759 | ^ 2024-06-05T15:57:01,760 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:01,760 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-06-05T15:57:01,769 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T15:57:01,771 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:01,771 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-06-05T15:57:01,780 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T15:57:01,786 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:01,787 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-06-05T15:57:01,787 | ^ 2024-06-05T15:57:01,788 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:01,788 1633 | maxidx = (LASTIDX= num && num_of_bits < 32) 2024-06-05T15:57:26,816 | ~~~~~^~~~~~ 2024-06-05T15:57:26,816 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-06-05T15:57:26,816 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:26,816 505 | while (bytes[num_of_bytes] >= num) 2024-06-05T15:57:26,817 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-06-05T15:57:26,818 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-06-05T15:57:26,819 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,819 614 | if (num_of_bits >= num_of_bytes * 8) 2024-06-05T15:57:26,819 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-06-05T15:57:26,819 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,819 616 | for (i = 0; i < num_of_bytes; i++) 2024-06-05T15:57:26,819 | ~~^~~~~~~~~~~~~~ 2024-06-05T15:57:26,820 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,820 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-06-05T15:57:26,820 | ~~^~~~~~~~~~~~~~~~ 2024-06-05T15:57:26,820 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-06-05T15:57:26,820 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:16: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:26,820 664 | if (lastbits < num_of_bits) 2024-06-05T15:57:26,820 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-06-05T15:57:26,824 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-06-05T15:57:26,824 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:26,824 785 | if(size3>xfp->buf1size) 2024-06-05T15:57:26,824 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T15:57:26,826 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:26,826 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-06-05T15:57:26,829 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:26,829 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,829 935 | if(countmjh >= size3 ) { return -1; } 2024-06-05T15:57:26,829 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:26,829 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,829 938 | if(countmjh >= size3 ) { return -1; } 2024-06-05T15:57:26,830 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:26,830 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,830 945 | if(countmjh >= size3 ) { return -1; } 2024-06-05T15:57:26,830 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:26,830 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,830 948 | if(countmjh >= size3 ) { return -1; } 2024-06-05T15:57:26,830 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:26,830 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,831 951 | if(countmjh >= size3 ) { return -1; } 2024-06-05T15:57:26,831 | ~~~~~~~~~^~~~~~~~ 2024-06-05T15:57:26,831 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:17: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-06-05T15:57:26,831 756 | int smallidx, minidx, maxidx; 2024-06-05T15:57:26,831 | ^~~~~~ 2024-06-05T15:57:26,831 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:25: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-06-05T15:57:26,831 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-06-05T15:57:26,831 | ^~~~~~ 2024-06-05T15:57:26,832 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:6: warning: unused variable ‘errval’ [-Wunused-variable] 2024-06-05T15:57:26,832 763 | int errval=1; 2024-06-05T15:57:26,832 | ^~~~~~ 2024-06-05T15:57:26,833 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-06-05T15:57:26,833 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:26,833 1011 | if(size3>xfp->buf1size) 2024-06-05T15:57:26,833 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T15:57:26,835 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:29: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,835 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T15:57:26,835 | ~~~~~~~~^~~~~~~ 2024-06-05T15:57:26,835 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,836 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T15:57:26,836 | ~~~~~~~~^~~~~~~ 2024-06-05T15:57:26,836 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,836 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T15:57:26,836 | ~~~~~~~~^~~~~~~ 2024-06-05T15:57:26,838 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,838 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-06-05T15:57:26,838 | ^ 2024-06-05T15:57:26,838 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:26,838 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-06-05T15:57:26,846 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T15:57:26,847 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:26,847 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-06-05T15:57:26,853 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T15:57:26,857 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:57:26,857 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-06-05T15:57:26,857 | ^ 2024-06-05T15:57:26,857 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:57:26,857 1633 | maxidx = (LASTIDX= __pyx_pybuffernd_forces.diminfo[2].shape)) __pyx_t_4 = 2; 2024-06-05T15:58:01,402 | ^ 2024-06-05T15:58:01,409 moleculekit/fileformats/xtc/trr.c:11555:19: warning: ‘__pyx_pybuffernd_forces.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,409 11555 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_forces.diminfo[1].shape)) __pyx_t_4 = 1; 2024-06-05T15:58:01,410 | ^ 2024-06-05T15:58:01,410 moleculekit/fileformats/xtc/trr.c:2509:95: warning: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,411 2509 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-06-05T15:58:01,411 | ^ 2024-06-05T15:58:01,416 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ was declared here 2024-06-05T15:58:01,416 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-06-05T15:58:01,416 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:58:01,422 moleculekit/fileformats/xtc/trr.c:11549:59: warning: ‘__pyx_pybuffernd_forces.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,422 11549 | __pyx_t_28 += __pyx_pybuffernd_forces.diminfo[0].shape; 2024-06-05T15:58:01,423 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-06-05T15:58:01,429 moleculekit/fileformats/xtc/trr.c:11502:19: warning: ‘__pyx_pybuffernd_vel.diminfo[2].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,429 11502 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_vel.diminfo[2].shape)) __pyx_t_4 = 2; 2024-06-05T15:58:01,429 | ^ 2024-06-05T15:58:01,436 moleculekit/fileformats/xtc/trr.c:11498:19: warning: ‘__pyx_pybuffernd_vel.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,436 11498 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_vel.diminfo[1].shape)) __pyx_t_4 = 1; 2024-06-05T15:58:01,436 | ^ 2024-06-05T15:58:01,437 moleculekit/fileformats/xtc/trr.c:2509:95: warning: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,437 2509 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-06-05T15:58:01,437 | ^ 2024-06-05T15:58:01,443 moleculekit/fileformats/xtc/trr.c:10107:21: note: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ was declared here 2024-06-05T15:58:01,443 10107 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-06-05T15:58:01,443 | ^~~~~~~~~~~~~~~~~~~~ 2024-06-05T15:58:01,449 moleculekit/fileformats/xtc/trr.c:11492:56: warning: ‘__pyx_pybuffernd_vel.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,449 11492 | __pyx_t_28 += __pyx_pybuffernd_vel.diminfo[0].shape; 2024-06-05T15:58:01,449 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-06-05T15:58:01,455 moleculekit/fileformats/xtc/trr.c:11891:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,455 11891 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_xyz_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-06-05T15:58:01,455 | ^ 2024-06-05T15:58:01,462 moleculekit/fileformats/xtc/trr.c:11887:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,462 11887 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_xyz_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-06-05T15:58:01,462 | ^ 2024-06-05T15:58:01,469 moleculekit/fileformats/xtc/trr.c:11732:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,469 11732 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_vel_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-06-05T15:58:01,470 | ^ 2024-06-05T15:58:01,476 moleculekit/fileformats/xtc/trr.c:11728:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,476 11728 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_vel_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-06-05T15:58:01,477 | ^ 2024-06-05T15:58:01,482 moleculekit/fileformats/xtc/trr.c:11784:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,482 11784 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_forces_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-06-05T15:58:01,483 | ^ 2024-06-05T15:58:01,489 moleculekit/fileformats/xtc/trr.c:11780:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:01,490 11780 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_forces_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-06-05T15:58:01,490 | ^ 2024-06-05T15:58:07,993 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 2024-06-05T15:58:08,221 building 'moleculekit.dcd' extension 2024-06-05T15:58:08,222 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-06-05T15:58:08,225 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-06-05T15:58:08,226 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-__t4ei7e/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 2024-06-05T15:58:08,552 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:58:08,552 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:58:08,552 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:58:08,552 from moleculekit/fileformats/dcd/dcd.c:1256: 2024-06-05T15:58:08,552 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:58:08,553 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:58:08,553 | ^~~~~~~ 2024-06-05T15:58:09,587 In file included from moleculekit/fileformats/dcd/include/dcdplugin.h:1, 2024-06-05T15:58:09,587 from moleculekit/fileformats/dcd/dcd.c:1262: 2024-06-05T15:58:09,587 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-06-05T15:58:09,587 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-06-05T15:58:09,587 | ^~~~~~~~~~~~~ 2024-06-05T15:58:09,588 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-06-05T15:58:09,588 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-06-05T15:58:09,588 | ^~~~~~~~~~~~~~ 2024-06-05T15:58:09,588 moleculekit/fileformats/dcd/include/fastio.h:466:12: warning: ‘fio_write_int32’ defined but not used [-Wunused-function] 2024-06-05T15:58:09,588 466 | static int fio_write_int32(fio_fd fd, int i) { 2024-06-05T15:58:09,588 | ^~~~~~~~~~~~~~~ 2024-06-05T15:58:09,589 moleculekit/fileformats/dcd/include/fastio.h:457:19: warning: ‘fio_ftell’ defined but not used [-Wunused-function] 2024-06-05T15:58:09,589 457 | static fio_size_t fio_ftell(fio_fd fd) { 2024-06-05T15:58:09,589 | ^~~~~~~~~ 2024-06-05T15:58:09,589 moleculekit/fileformats/dcd/include/fastio.h:450:19: warning: ‘fio_fseek’ defined but not used [-Wunused-function] 2024-06-05T15:58:09,589 450 | static fio_size_t fio_fseek(fio_fd fd, fio_size_t offset, int whence) { 2024-06-05T15:58:09,589 | ^~~~~~~~~ 2024-06-05T15:58:09,589 moleculekit/fileformats/dcd/include/fastio.h:415:19: warning: ‘fio_readv’ defined but not used [-Wunused-function] 2024-06-05T15:58:09,589 415 | static fio_size_t fio_readv(fio_fd fd, const fio_iovec * iov, int iovcnt) { 2024-06-05T15:58:09,590 | ^~~~~~~~~ 2024-06-05T15:58:09,590 moleculekit/fileformats/dcd/include/fastio.h:394:12: warning: ‘fio_fclose’ defined but not used [-Wunused-function] 2024-06-05T15:58:09,590 394 | static int fio_fclose(fio_fd fd) { 2024-06-05T15:58:09,590 | ^~~~~~~~~~ 2024-06-05T15:58:09,590 moleculekit/fileformats/dcd/include/fastio.h:366:12: warning: ‘fio_open’ defined but not used [-Wunused-function] 2024-06-05T15:58:09,590 366 | static int fio_open(const char *filename, int mode, fio_fd *fd) { 2024-06-05T15:58:09,590 | ^~~~~~~~ 2024-06-05T15:58:22,189 moleculekit/fileformats/dcd/dcd.c: In function ‘__pyx_pf_11moleculekit_3dcd_17DCDTrajectoryFile_18read’: 2024-06-05T15:58:22,189 moleculekit/fileformats/dcd/dcd.c:1158:40: warning: ‘__pyx_v_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:22,189 1158 | #define PyInt_FromLong PyLong_FromLong 2024-06-05T15:58:22,189 | ^~~~~~~~~~~~~~~ 2024-06-05T15:58:22,193 moleculekit/fileformats/dcd/dcd.c:8022:7: note: ‘__pyx_v_i’ was declared here 2024-06-05T15:58:22,193 8022 | int __pyx_v_i; 2024-06-05T15:58:22,194 | ^~~~~~~~~ 2024-06-05T15:58:25,509 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-__t4ei7e/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 2024-06-05T15:58:25,694 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdheader’: 2024-06-05T15:58:25,694 moleculekit/fileformats/dcd/src/dcdplugin.c:150:55: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:58:25,694 150 | else if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-06-05T15:58:25,695 | ^~ 2024-06-05T15:58:25,695 moleculekit/fileformats/dcd/src/dcdplugin.c:173:54: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:58:25,695 173 | if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-06-05T15:58:25,695 | ^~ 2024-06-05T15:58:25,695 moleculekit/fileformats/dcd/src/dcdplugin.c:194:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:58:25,695 194 | if (input_integer[0] != dcdcordmagic) 2024-06-05T15:58:25,695 | ^~ 2024-06-05T15:58:25,698 moleculekit/fileformats/dcd/src/dcdplugin.c:409:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:58:25,699 409 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-06-05T15:58:25,699 | ^~ 2024-06-05T15:58:25,699 moleculekit/fileformats/dcd/src/dcdplugin.c:428:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T15:58:25,699 428 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-06-05T15:58:25,699 | ^~ 2024-06-05T15:58:25,703 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdstep’: 2024-06-05T15:58:25,703 moleculekit/fileformats/dcd/src/dcdplugin.c:651:23: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:58:25,703 651 | if (tmpbuf[i] != sizeof(float) * N) 2024-06-05T15:58:25,703 | ^~ 2024-06-05T15:58:25,703 moleculekit/fileformats/dcd/src/dcdplugin.c:659:49: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T15:58:25,704 659 | if ((tmpbuf[2 * i] + tmpbuf[2 * i + 1]) != sizeof(float) * N) 2024-06-05T15:58:25,704 | ^~ 2024-06-05T15:58:25,726 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:55: 2024-06-05T15:58:25,727 At top level: 2024-06-05T15:58:25,727 moleculekit/fileformats/dcd/include/endianswap.h:96:13: warning: ‘swap2_aligned’ defined but not used [-Wunused-function] 2024-06-05T15:58:25,727 96 | static void swap2_aligned(void *v, long ndata) { 2024-06-05T15:58:25,727 | ^~~~~~~~~~~~~ 2024-06-05T15:58:25,727 moleculekit/fileformats/dcd/include/endianswap.h:32:13: warning: ‘swap2_unaligned’ defined but not used [-Wunused-function] 2024-06-05T15:58:25,727 32 | static void swap2_unaligned(void *v, long ndata) { 2024-06-05T15:58:25,727 | ^~~~~~~~~~~~~~~ 2024-06-05T15:58:25,728 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:46: 2024-06-05T15:58:25,728 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-06-05T15:58:25,728 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-06-05T15:58:25,728 | ^~~~~~~~~~~~~ 2024-06-05T15:58:25,728 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-06-05T15:58:25,728 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-06-05T15:58:25,728 | ^~~~~~~~~~~~~~ 2024-06-05T15:58:26,837 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 2024-06-05T15:58:27,013 building 'moleculekit.binpos' extension 2024-06-05T15:58:27,013 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-06-05T15:58:27,014 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-06-05T15:58:27,015 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-__t4ei7e/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 2024-06-05T15:58:27,333 In file included from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T15:58:27,333 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T15:58:27,333 from /tmp/pip-build-env-__t4ei7e/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T15:58:27,333 from moleculekit/fileformats/binpos/binpos.c:1256: 2024-06-05T15:58:27,333 /tmp/pip-build-env-__t4ei7e/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] 2024-06-05T15:58:27,334 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T15:58:27,334 | ^~~~~~~ 2024-06-05T15:58:40,806 moleculekit/fileformats/binpos/binpos.c: In function ‘__pyx_pw_11moleculekit_6binpos_20BINPOSTrajectoryFile_7_read’: 2024-06-05T15:58:40,810 moleculekit/fileformats/binpos/binpos.c:8045:6: warning: ‘__pyx_v_status’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:40,810 8045 | if (__pyx_t_1) { 2024-06-05T15:58:40,810 | ^ 2024-06-05T15:58:40,814 moleculekit/fileformats/binpos/binpos.c:7522:7: note: ‘__pyx_v_status’ was declared here 2024-06-05T15:58:40,814 7522 | int __pyx_v_status; 2024-06-05T15:58:40,815 | ^~~~~~~~~~~~~~ 2024-06-05T15:58:40,815 moleculekit/fileformats/binpos/binpos.c:1158:40: warning: ‘__pyx_v_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-06-05T15:58:40,815 1158 | #define PyInt_FromLong PyLong_FromLong 2024-06-05T15:58:40,815 | ^~~~~~~~~~~~~~~ 2024-06-05T15:58:40,819 moleculekit/fileformats/binpos/binpos.c:7519:7: note: ‘__pyx_v_i’ was declared here 2024-06-05T15:58:40,819 7519 | int __pyx_v_i; 2024-06-05T15:58:40,820 | ^~~~~~~~~ 2024-06-05T15:58:43,116 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-__t4ei7e/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 2024-06-05T15:58:43,414 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 2024-06-05T15:58:43,553 building 'moleculekit.tmalign' extension 2024-06-05T15:58:43,554 creating build/temp.linux-armv7l-cpython-39/moleculekit/tmalign 2024-06-05T15:58:43,555 creating build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-06-05T15:58:43,556 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-__t4ei7e/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 2024-06-05T15:59:13,257 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-__t4ei7e/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 2024-06-05T15:59:31,783 In file included from /usr/include/c++/10/vector:72, 2024-06-05T15:59:31,783 from moleculekit/tmalign/tmalign_util.cpp:1280: 2024-06-05T15:59:31,783 /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]’: 2024-06-05T15:59:31,784 /usr/include/c++/10/bits/vector.tcc:426:7: note: parameter passing for argument of type ‘std::vector::iterator’ changed in GCC 7.1 2024-06-05T15:59:31,784 426 | vector<_Tp, _Alloc>:: 2024-06-05T15:59:31,784 | ^~~~~~~~~~~~~~~~~~~ 2024-06-05T15:59:32,362 In file included from /usr/include/c++/10/vector:67, 2024-06-05T15:59:32,363 from moleculekit/tmalign/tmalign_util.cpp:1280: 2024-06-05T15:59:32,363 /usr/include/c++/10/bits/stl_vector.h: In function ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-06-05T15:59:32,363 /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 2024-06-05T15:59:32,363 1198 | _M_realloc_insert(end(), __x); 2024-06-05T15:59:32,363 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-06-05T15:59:32,364 /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 2024-06-05T15:59:32,364 1198 | _M_realloc_insert(end(), __x); 2024-06-05T15:59:32,364 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-06-05T15:59:32,364 /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 2024-06-05T15:59:32,365 1198 | _M_realloc_insert(end(), __x); 2024-06-05T15:59:32,365 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-06-05T15:59:34,836 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 2024-06-05T15:59:35,316 UPDATING build/lib.linux-armv7l-cpython-39/moleculekit/_version.py 2024-06-05T15:59:35,316 set build/lib.linux-armv7l-cpython-39/moleculekit/_version.py to '1.8.33' 2024-06-05T15:59:35,316 installing to build/bdist.linux-armv7l/wheel 2024-06-05T15:59:35,316 running install 2024-06-05T15:59:35,343 running install_lib 2024-06-05T15:59:35,350 creating build/bdist.linux-armv7l 2024-06-05T15:59:35,351 creating build/bdist.linux-armv7l/wheel 2024-06-05T15:59:35,353 creating build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:35,355 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-06-05T15:59:35,356 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-06-05T15:59:35,390 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-06-05T15:59:35,393 creating build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-06-05T15:59:35,395 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-06-05T15:59:35,397 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-06-05T15:59:35,425 creating build/bdist.linux-armv7l/wheel/moleculekit/share 2024-06-05T15:59:35,427 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/backbone.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-06-05T15:59:35,429 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/opm_sequences.json -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-06-05T15:59:35,697 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr 2024-06-05T15:59:35,701 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,702 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,703 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TPO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,705 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/5JP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,707 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,709 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,711 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/FGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,713 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,715 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,716 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,718 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HHK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,721 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,723 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,725 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,727 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,729 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0BN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,730 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,732 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,734 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GNC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,737 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,738 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,740 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/1MH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,742 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,744 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,746 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ESC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,748 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,750 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YCM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,752 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YCM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,753 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2AS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,755 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HQA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,757 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,759 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2MR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,761 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BB8.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,763 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HYP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,765 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,766 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/M3L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,768 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/.gitkeep -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,770 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,771 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/004.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,773 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0AF.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,775 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0A1.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,777 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,779 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,781 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,782 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2GX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,784 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAB.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,786 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YNM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,789 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4IN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,791 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BB8.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,793 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ORM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,795 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OMX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,796 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,798 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,800 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/5JP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,801 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YNM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,803 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PRK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,805 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AHP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,806 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,808 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TY2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,810 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,812 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,814 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,816 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/SEP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,817 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,819 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TY2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,821 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NAL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,823 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DPP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,825 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,826 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,828 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/I2M.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,830 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,833 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,835 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,836 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/APD.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,838 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/KYN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,840 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,842 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TRO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,844 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HPE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,846 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2MR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,848 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HQA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,850 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/P1L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,852 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,854 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2ML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,855 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AHP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,857 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,859 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,861 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/D4P.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,863 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,864 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ONL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,866 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HOX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,868 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,869 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,871 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,873 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,875 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TPO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,876 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PCA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,878 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,880 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CGU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,881 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MMO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,883 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IIL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,885 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,887 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0A1.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,888 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DA2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,890 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,892 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/03Y.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,894 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/D4P.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,896 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ME0.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,897 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MMO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,899 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/P1L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,901 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2GX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,903 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,905 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DA2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,906 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PCA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,908 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/SEP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,910 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,912 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TRO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,913 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HHK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,915 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2AS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,917 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GNC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,918 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ORM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,920 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/KYN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,922 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAB.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,923 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/APD.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,925 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/I2M.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,926 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BTK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,928 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PRK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,931 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,933 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,934 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AA4.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,936 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AA4.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,938 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ONL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,940 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/1MH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,942 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,944 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BTK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,945 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HYP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,947 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ESC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,949 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2ML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,950 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,952 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,954 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,956 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0AF.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,957 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,959 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CGU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,961 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,962 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OMX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,964 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4IN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,966 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,968 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,969 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/M3L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,972 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GHG.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,974 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NAL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,975 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,977 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/03Y.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,979 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,980 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ABA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,982 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,984 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,986 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DPP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,987 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NZC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,989 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GHG.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,991 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ABA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,992 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ME0.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,994 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IIL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,996 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0BN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:35,998 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,000 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,002 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,004 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,006 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/FGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,008 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HPE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,009 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,011 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/004.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,013 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,015 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HOX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,018 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NZC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,020 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T15:59:36,022 creating build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-06-05T15:59:36,023 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect/atomselect.json -> build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-06-05T15:59:36,026 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/ALA.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-06-05T15:59:36,028 copying build/lib.linux-armv7l-cpython-39/moleculekit/periodictable.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,032 creating build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-06-05T15:59:36,033 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-06-05T15:59:36,035 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-06-05T15:59:36,065 creating build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-06-05T15:59:36,066 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-06-05T15:59:36,111 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-06-05T15:59:36,114 copying build/lib.linux-armv7l-cpython-39/moleculekit/opm.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,117 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-06-05T15:59:36,119 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-06-05T15:59:36,120 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-06-05T15:59:36,123 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-06-05T15:59:36,124 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src/binposplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-06-05T15:59:36,127 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binposlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-06-05T15:59:36,129 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-06-05T15:59:36,131 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/binposplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-06-05T15:59:36,133 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-06-05T15:59:36,135 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-06-05T15:59:36,138 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-06-05T15:59:36,158 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/netcdf.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-06-05T15:59:36,162 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T15:59:36,163 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T15:59:36,190 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtclib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T15:59:36,192 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T15:59:36,194 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtc.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T15:59:36,195 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xdrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T15:59:36,197 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T15:59:36,221 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T15:59:36,222 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T15:59:36,225 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T15:59:36,228 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T15:59:36,230 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T15:59:36,232 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdr_seek.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T15:59:36,234 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T15:59:36,235 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T15:59:36,237 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdr_seek.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T15:59:36,239 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/trr_header.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T15:59:36,241 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T15:59:36,242 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T15:59:36,244 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T15:59:36,247 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trr.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T15:59:36,250 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-06-05T15:59:36,251 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-06-05T15:59:36,252 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src/dcdplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-06-05T15:59:36,256 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcdlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-06-05T15:59:36,257 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-06-05T15:59:36,276 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-06-05T15:59:36,279 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T15:59:36,280 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T15:59:36,282 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/endianswap.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T15:59:36,284 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/dcdplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T15:59:36,286 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T15:59:36,288 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/fastio.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T15:59:36,291 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/utils.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-06-05T15:59:36,293 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-06-05T15:59:36,295 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-06-05T15:59:36,296 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-06-05T15:59:36,297 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src/TMAlign.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-06-05T15:59:36,303 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-06-05T15:59:36,305 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-06-05T15:59:36,335 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-06-05T15:59:36,335 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include/TMAlign.h -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-06-05T15:59:36,337 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalignlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-06-05T15:59:36,339 copying build/lib.linux-armv7l-cpython-39/moleculekit/readers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,345 creating build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-06-05T15:59:36,345 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-06-05T15:59:36,347 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-06-05T15:59:36,371 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,374 creating build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,375 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/projection.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,377 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsasa.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,379 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metrictmscore.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,381 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricshell.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,384 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metriccoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,386 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricrmsd.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,389 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricplumed2.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,391 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricgyration.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,394 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,395 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricdihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,398 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,400 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsecondarystructure.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,402 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricfluctuation.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,405 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricdistance.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,408 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsphericalcoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T15:59:36,411 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,442 copying build/lib.linux-armv7l-cpython-39/moleculekit/viewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,444 copying build/lib.linux-armv7l-cpython-39/moleculekit/binpos.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,462 copying build/lib.linux-armv7l-cpython-39/moleculekit/dihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,464 copying build/lib.linux-armv7l-cpython-39/moleculekit/logging.ini -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,466 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,560 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmdgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,562 copying build/lib.linux-armv7l-cpython-39/moleculekit/config.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,565 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,591 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,594 creating build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,595 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/voxeldescriptors.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,598 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/sequencestructuralalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,600 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/docking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,602 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/modelling.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,604 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/moleculechecks.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,606 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/autosegment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,608 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/atomtyper.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,611 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/preparation_customres.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,613 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/graphalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,615 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/detect.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,618 creating build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-06-05T15:59:36,619 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools/obabel_cli.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-06-05T15:59:36,621 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-06-05T15:59:36,623 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/preparation.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,626 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/crystalpacking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,628 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,630 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/hhblitsprofile.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T15:59:36,632 copying build/lib.linux-armv7l-cpython-39/moleculekit/writers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,635 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-06-05T15:59:36,636 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/analyze.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-06-05T15:59:36,638 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/atomselect.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-06-05T15:59:36,641 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-06-05T15:59:36,642 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/languageparser.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-06-05T15:59:36,644 copying build/lib.linux-armv7l-cpython-39/moleculekit/home.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,646 copying build/lib.linux-armv7l-cpython-39/moleculekit/trr.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,682 copying build/lib.linux-armv7l-cpython-39/moleculekit/rdkitintegration.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,684 copying build/lib.linux-armv7l-cpython-39/moleculekit/_version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,686 copying build/lib.linux-armv7l-cpython-39/moleculekit/dcd.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,701 copying build/lib.linux-armv7l-cpython-39/moleculekit/version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,703 creating build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-06-05T15:59:36,704 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/yacc.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-06-05T15:59:36,709 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/lex.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-06-05T15:59:36,711 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-06-05T15:59:36,713 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,746 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmdviewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,748 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,772 creating build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-06-05T15:59:36,773 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-06-05T15:59:36,801 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-06-05T15:59:36,804 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,876 copying build/lib.linux-armv7l-cpython-39/moleculekit/rcsb.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:36,879 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T15:59:36,880 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-06-05T15:59:36,881 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-06-05T15:59:36,884 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-06-05T15:59:36,906 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-06-05T15:59:36,907 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-06-05T15:59:36,973 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-06-05T15:59:36,976 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/interactions.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T15:59:36,979 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T15:59:37,086 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T15:59:37,129 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-06-05T15:59:37,131 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-06-05T15:59:37,134 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-06-05T15:59:37,168 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T15:59:37,200 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-06-05T15:59:37,201 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-06-05T15:59:37,204 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-06-05T15:59:37,225 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T15:59:37,257 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T15:59:37,259 copying build/lib.linux-armv7l-cpython-39/moleculekit/pymolgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:37,261 copying build/lib.linux-armv7l-cpython-39/moleculekit/molecule.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:37,266 copying build/lib.linux-armv7l-cpython-39/moleculekit/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:37,268 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T15:59:37,270 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmolcdp.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T15:59:37,272 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/test_smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T15:59:37,275 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/test_smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T15:59:37,278 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T15:59:37,281 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T15:59:37,284 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-06-05T15:59:37,285 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/clustering.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-06-05T15:59:37,288 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/restrainedembed.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-06-05T15:59:37,290 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-06-05T15:59:37,293 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/test_tools.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-06-05T15:59:37,295 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T15:59:37,297 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T15:59:37,300 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:37,324 copying build/lib.linux-armv7l-cpython-39/moleculekit/util.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:37,327 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:37,349 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmd_wrapper -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:37,351 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-06-05T15:59:37,352 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-06-05T15:59:37,353 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxParser.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-06-05T15:59:37,356 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxReader.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-06-05T15:59:37,358 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-06-05T15:59:37,360 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxContainers.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-06-05T15:59:37,363 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-06-05T15:59:37,364 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer/PdbxWriter.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-06-05T15:59:37,366 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-06-05T15:59:37,368 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-06-05T15:59:37,369 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxWriterTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-06-05T15:59:37,371 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxReaderTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-06-05T15:59:37,373 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-06-05T15:59:37,376 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-06-05T15:59:37,377 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-06-05T15:59:37,378 copying build/lib.linux-armv7l-cpython-39/moleculekit/align.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T15:59:37,380 running install_egg_info 2024-06-05T15:59:37,386 Copying moleculekit.egg-info to build/bdist.linux-armv7l/wheel/moleculekit-1.8.33-py3.9.egg-info 2024-06-05T15:59:37,398 running install_scripts 2024-06-05T15:59:37,447 creating build/bdist.linux-armv7l/wheel/moleculekit-1.8.33.dist-info/WHEEL 2024-06-05T15:59:37,450 creating '/tmp/pip-wheel-u6c7q0cl/.tmp-qd7gi3pp/moleculekit-1.8.33-cp39-cp39-linux_armv7l.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2024-06-05T15:59:37,453 adding 'moleculekit/__init__.py' 2024-06-05T15:59:37,454 adding 'moleculekit/_version.py' 2024-06-05T15:59:37,456 adding 'moleculekit/align.py' 2024-06-05T15:59:37,810 adding 'moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:37,972 adding 'moleculekit/binpos.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:37,979 adding 'moleculekit/bondguesser.py' 2024-06-05T15:59:38,223 adding 'moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:38,232 adding 'moleculekit/config.py' 2024-06-05T15:59:38,491 adding 'moleculekit/cython_utils.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:38,664 adding 'moleculekit/dcd.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:38,670 adding 'moleculekit/dihedral.py' 2024-06-05T15:59:38,672 adding 'moleculekit/distance.py' 2024-06-05T15:59:39,003 adding 'moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:39,015 adding 'moleculekit/home.py' 2024-06-05T15:59:39,016 adding 'moleculekit/logging.ini' 2024-06-05T15:59:39,031 adding 'moleculekit/molecule.py' 2024-06-05T15:59:39,258 adding 'moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:39,267 adding 'moleculekit/opm.py' 2024-06-05T15:59:39,269 adding 'moleculekit/periodictable.py' 2024-06-05T15:59:39,270 adding 'moleculekit/pymolgraphics.py' 2024-06-05T15:59:39,272 adding 'moleculekit/rcsb.py' 2024-06-05T15:59:39,273 adding 'moleculekit/rdkitintegration.py' 2024-06-05T15:59:39,286 adding 'moleculekit/readers.py' 2024-06-05T15:59:39,899 adding 'moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:40,214 adding 'moleculekit/trr.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:40,226 adding 'moleculekit/util.py' 2024-06-05T15:59:40,228 adding 'moleculekit/version.py' 2024-06-05T15:59:40,229 adding 'moleculekit/viewer.py' 2024-06-05T15:59:40,231 adding 'moleculekit/vmd_wrapper' 2024-06-05T15:59:40,232 adding 'moleculekit/vmdgraphics.py' 2024-06-05T15:59:40,235 adding 'moleculekit/vmdviewer.py' 2024-06-05T15:59:40,488 adding 'moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:40,503 adding 'moleculekit/writers.py' 2024-06-05T15:59:40,772 adding 'moleculekit/xtc.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:40,782 adding 'moleculekit/atomselect/__init__.py' 2024-06-05T15:59:40,784 adding 'moleculekit/atomselect/analyze.py' 2024-06-05T15:59:40,786 adding 'moleculekit/atomselect/atomselect.py' 2024-06-05T15:59:40,788 adding 'moleculekit/atomselect/languageparser.py' 2024-06-05T15:59:40,892 adding 'moleculekit/atomselect_utils/atomselect_utils.cpp' 2024-06-05T15:59:40,903 adding 'moleculekit/atomselect_utils/atomselect_utils.pyx' 2024-06-05T15:59:40,996 adding 'moleculekit/bondguesser_utils/bondguesser_utils.cpp' 2024-06-05T15:59:41,005 adding 'moleculekit/bondguesser_utils/bondguesser_utils.pyx' 2024-06-05T15:59:41,095 adding 'moleculekit/cython_utils/cython_utils.cpp' 2024-06-05T15:59:41,104 adding 'moleculekit/cython_utils/cython_utils.pyx' 2024-06-05T15:59:41,208 adding 'moleculekit/distance_utils/distance_utils.cpp' 2024-06-05T15:59:41,219 adding 'moleculekit/distance_utils/distance_utils.pyx' 2024-06-05T15:59:41,223 adding 'moleculekit/fileformats/__init__.py' 2024-06-05T15:59:41,228 adding 'moleculekit/fileformats/netcdf.py' 2024-06-05T15:59:41,230 adding 'moleculekit/fileformats/utils.py' 2024-06-05T15:59:41,292 adding 'moleculekit/fileformats/binpos/binpos.c' 2024-06-05T15:59:41,299 adding 'moleculekit/fileformats/binpos/binpos.pyx' 2024-06-05T15:59:41,301 adding 'moleculekit/fileformats/binpos/binposlib.pxd' 2024-06-05T15:59:41,302 adding 'moleculekit/fileformats/binpos/include/binposplugin.h' 2024-06-05T15:59:41,304 adding 'moleculekit/fileformats/binpos/include/largefiles.h' 2024-06-05T15:59:41,309 adding 'moleculekit/fileformats/binpos/include/molfile_plugin.h' 2024-06-05T15:59:41,311 adding 'moleculekit/fileformats/binpos/src/binposplugin.c' 2024-06-05T15:59:41,375 adding 'moleculekit/fileformats/dcd/dcd.c' 2024-06-05T15:59:41,383 adding 'moleculekit/fileformats/dcd/dcd.pyx' 2024-06-05T15:59:41,384 adding 'moleculekit/fileformats/dcd/dcdlib.pxd' 2024-06-05T15:59:41,386 adding 'moleculekit/fileformats/dcd/include/dcdplugin.h' 2024-06-05T15:59:41,387 adding 'moleculekit/fileformats/dcd/include/endianswap.h' 2024-06-05T15:59:41,389 adding 'moleculekit/fileformats/dcd/include/fastio.h' 2024-06-05T15:59:41,391 adding 'moleculekit/fileformats/dcd/include/largefiles.h' 2024-06-05T15:59:41,396 adding 'moleculekit/fileformats/dcd/include/molfile_plugin.h' 2024-06-05T15:59:41,401 adding 'moleculekit/fileformats/dcd/src/dcdplugin.c' 2024-06-05T15:59:41,497 adding 'moleculekit/fileformats/xtc/trr.c' 2024-06-05T15:59:41,509 adding 'moleculekit/fileformats/xtc/trr.pyx' 2024-06-05T15:59:41,510 adding 'moleculekit/fileformats/xtc/trrlib.pxd' 2024-06-05T15:59:41,511 adding 'moleculekit/fileformats/xtc/xdrlib.pxd' 2024-06-05T15:59:41,602 adding 'moleculekit/fileformats/xtc/xtc.cpp' 2024-06-05T15:59:41,611 adding 'moleculekit/fileformats/xtc/xtc.pyx' 2024-06-05T15:59:41,612 adding 'moleculekit/fileformats/xtc/xtclib.pxd' 2024-06-05T15:59:41,614 adding 'moleculekit/fileformats/xtc/include/trr_header.h' 2024-06-05T15:59:41,615 adding 'moleculekit/fileformats/xtc/include/xdr_seek.h' 2024-06-05T15:59:41,618 adding 'moleculekit/fileformats/xtc/include/xdrfile.h' 2024-06-05T15:59:41,619 adding 'moleculekit/fileformats/xtc/include/xdrfile_trr.h' 2024-06-05T15:59:41,620 adding 'moleculekit/fileformats/xtc/include/xdrfile_xtc.h' 2024-06-05T15:59:41,622 adding 'moleculekit/fileformats/xtc/include/xtc.h' 2024-06-05T15:59:41,623 adding 'moleculekit/fileformats/xtc/src/xdr_seek.c' 2024-06-05T15:59:41,630 adding 'moleculekit/fileformats/xtc/src/xdrfile.cpp' 2024-06-05T15:59:41,634 adding 'moleculekit/fileformats/xtc/src/xdrfile_trr.c' 2024-06-05T15:59:41,636 adding 'moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp' 2024-06-05T15:59:41,638 adding 'moleculekit/fileformats/xtc/src/xtc.cpp' 2024-06-05T15:59:41,640 adding 'moleculekit/interactions/__init__.py' 2024-06-05T15:59:41,927 adding 'moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:42,198 adding 'moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:42,210 adding 'moleculekit/interactions/interactions.py' 2024-06-05T15:59:42,494 adding 'moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:42,786 adding 'moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so' 2024-06-05T15:59:42,888 adding 'moleculekit/interactions/cationpi/cationpi.cpp' 2024-06-05T15:59:42,897 adding 'moleculekit/interactions/cationpi/cationpi.pyx' 2024-06-05T15:59:42,989 adding 'moleculekit/interactions/hbonds/hbonds.cpp' 2024-06-05T15:59:42,998 adding 'moleculekit/interactions/hbonds/hbonds.pyx' 2024-06-05T15:59:43,091 adding 'moleculekit/interactions/pipi/pipi.cpp' 2024-06-05T15:59:43,100 adding 'moleculekit/interactions/pipi/pipi.pyx' 2024-06-05T15:59:43,193 adding 'moleculekit/interactions/sigmahole/sigmahole.cpp' 2024-06-05T15:59:43,202 adding 'moleculekit/interactions/sigmahole/sigmahole.pyx' 2024-06-05T15:59:43,290 adding 'moleculekit/occupancy_utils/occupancy_utils.cpp' 2024-06-05T15:59:43,298 adding 'moleculekit/occupancy_utils/occupancy_utils.pyx' 2024-06-05T15:59:43,300 adding 'moleculekit/pdbx/__init__.py' 2024-06-05T15:59:43,304 adding 'moleculekit/pdbx/reader/PdbxContainers.py' 2024-06-05T15:59:43,307 adding 'moleculekit/pdbx/reader/PdbxParser.py' 2024-06-05T15:59:43,309 adding 'moleculekit/pdbx/reader/PdbxReader.py' 2024-06-05T15:59:43,310 adding 'moleculekit/pdbx/reader/__init__.py' 2024-06-05T15:59:43,312 adding 'moleculekit/pdbx/tests/PdbxReadWriteTests.py' 2024-06-05T15:59:43,314 adding 'moleculekit/pdbx/tests/PdbxReaderTests.py' 2024-06-05T15:59:43,315 adding 'moleculekit/pdbx/tests/PdbxWriterTests.py' 2024-06-05T15:59:43,316 adding 'moleculekit/pdbx/tests/__init__.py' 2024-06-05T15:59:43,318 adding 'moleculekit/pdbx/writer/PdbxWriter.py' 2024-06-05T15:59:43,319 adding 'moleculekit/pdbx/writer/__init__.py' 2024-06-05T15:59:43,321 adding 'moleculekit/ply/__init__.py' 2024-06-05T15:59:43,325 adding 'moleculekit/ply/lex.py' 2024-06-05T15:59:43,339 adding 'moleculekit/ply/yacc.py' 2024-06-05T15:59:43,341 adding 'moleculekit/projections/__init__.py' 2024-06-05T15:59:43,343 adding 'moleculekit/projections/metriccoordinate.py' 2024-06-05T15:59:43,346 adding 'moleculekit/projections/metricdihedral.py' 2024-06-05T15:59:43,350 adding 'moleculekit/projections/metricdistance.py' 2024-06-05T15:59:43,352 adding 'moleculekit/projections/metricfluctuation.py' 2024-06-05T15:59:43,354 adding 'moleculekit/projections/metricgyration.py' 2024-06-05T15:59:43,358 adding 'moleculekit/projections/metricplumed2.py' 2024-06-05T15:59:43,360 adding 'moleculekit/projections/metricrmsd.py' 2024-06-05T15:59:43,362 adding 'moleculekit/projections/metricsasa.py' 2024-06-05T15:59:43,364 adding 'moleculekit/projections/metricsecondarystructure.py' 2024-06-05T15:59:43,366 adding 'moleculekit/projections/metricshell.py' 2024-06-05T15:59:43,367 adding 'moleculekit/projections/metricsphericalcoordinate.py' 2024-06-05T15:59:43,369 adding 'moleculekit/projections/metrictmscore.py' 2024-06-05T15:59:43,370 adding 'moleculekit/projections/projection.py' 2024-06-05T15:59:43,371 adding 'moleculekit/projections/util.py' 2024-06-05T15:59:43,374 adding 'moleculekit/share/ALA.cif' 2024-06-05T15:59:43,375 adding 'moleculekit/share/backbone.cif' 2024-06-05T15:59:44,679 adding 'moleculekit/share/opm_sequences.json' 2024-06-05T15:59:44,765 adding 'moleculekit/share/atomselect/atomselect.json' 2024-06-05T15:59:44,770 adding 'moleculekit/share/pdb2pqr/residues/.gitkeep' 2024-06-05T15:59:44,771 adding 'moleculekit/share/pdb2pqr/residues/004.dat' 2024-06-05T15:59:44,772 adding 'moleculekit/share/pdb2pqr/residues/004.xml' 2024-06-05T15:59:44,773 adding 'moleculekit/share/pdb2pqr/residues/03Y.dat' 2024-06-05T15:59:44,775 adding 'moleculekit/share/pdb2pqr/residues/03Y.xml' 2024-06-05T15:59:44,776 adding 'moleculekit/share/pdb2pqr/residues/0A1.dat' 2024-06-05T15:59:44,777 adding 'moleculekit/share/pdb2pqr/residues/0A1.xml' 2024-06-05T15:59:44,778 adding 'moleculekit/share/pdb2pqr/residues/0AF.dat' 2024-06-05T15:59:44,780 adding 'moleculekit/share/pdb2pqr/residues/0AF.xml' 2024-06-05T15:59:44,781 adding 'moleculekit/share/pdb2pqr/residues/0BN.dat' 2024-06-05T15:59:44,782 adding 'moleculekit/share/pdb2pqr/residues/0BN.xml' 2024-06-05T15:59:44,783 adding 'moleculekit/share/pdb2pqr/residues/1MH.dat' 2024-06-05T15:59:44,785 adding 'moleculekit/share/pdb2pqr/residues/1MH.xml' 2024-06-05T15:59:44,786 adding 'moleculekit/share/pdb2pqr/residues/2AS.dat' 2024-06-05T15:59:44,787 adding 'moleculekit/share/pdb2pqr/residues/2AS.xml' 2024-06-05T15:59:44,788 adding 'moleculekit/share/pdb2pqr/residues/2GX.dat' 2024-06-05T15:59:44,790 adding 'moleculekit/share/pdb2pqr/residues/2GX.xml' 2024-06-05T15:59:44,791 adding 'moleculekit/share/pdb2pqr/residues/2ML.dat' 2024-06-05T15:59:44,792 adding 'moleculekit/share/pdb2pqr/residues/2ML.xml' 2024-06-05T15:59:44,793 adding 'moleculekit/share/pdb2pqr/residues/2MR.dat' 2024-06-05T15:59:44,795 adding 'moleculekit/share/pdb2pqr/residues/2MR.xml' 2024-06-05T15:59:44,796 adding 'moleculekit/share/pdb2pqr/residues/4IN.dat' 2024-06-05T15:59:44,797 adding 'moleculekit/share/pdb2pqr/residues/4IN.xml' 2024-06-05T15:59:44,798 adding 'moleculekit/share/pdb2pqr/residues/4PH.dat' 2024-06-05T15:59:44,800 adding 'moleculekit/share/pdb2pqr/residues/4PH.xml' 2024-06-05T15:59:44,801 adding 'moleculekit/share/pdb2pqr/residues/4PQ.dat' 2024-06-05T15:59:44,802 adding 'moleculekit/share/pdb2pqr/residues/4PQ.xml' 2024-06-05T15:59:44,803 adding 'moleculekit/share/pdb2pqr/residues/5JP.dat' 2024-06-05T15:59:44,805 adding 'moleculekit/share/pdb2pqr/residues/5JP.xml' 2024-06-05T15:59:44,806 adding 'moleculekit/share/pdb2pqr/residues/AA4.dat' 2024-06-05T15:59:44,807 adding 'moleculekit/share/pdb2pqr/residues/AA4.xml' 2024-06-05T15:59:44,808 adding 'moleculekit/share/pdb2pqr/residues/ABA.dat' 2024-06-05T15:59:44,810 adding 'moleculekit/share/pdb2pqr/residues/ABA.xml' 2024-06-05T15:59:44,811 adding 'moleculekit/share/pdb2pqr/residues/AHP.dat' 2024-06-05T15:59:44,812 adding 'moleculekit/share/pdb2pqr/residues/AHP.xml' 2024-06-05T15:59:44,813 adding 'moleculekit/share/pdb2pqr/residues/ALC.dat' 2024-06-05T15:59:44,815 adding 'moleculekit/share/pdb2pqr/residues/ALC.xml' 2024-06-05T15:59:44,816 adding 'moleculekit/share/pdb2pqr/residues/ALN.dat' 2024-06-05T15:59:44,817 adding 'moleculekit/share/pdb2pqr/residues/ALN.xml' 2024-06-05T15:59:44,818 adding 'moleculekit/share/pdb2pqr/residues/ALY.dat' 2024-06-05T15:59:44,820 adding 'moleculekit/share/pdb2pqr/residues/ALY.xml' 2024-06-05T15:59:44,821 adding 'moleculekit/share/pdb2pqr/residues/APD.dat' 2024-06-05T15:59:44,822 adding 'moleculekit/share/pdb2pqr/residues/APD.xml' 2024-06-05T15:59:44,823 adding 'moleculekit/share/pdb2pqr/residues/BB8.dat' 2024-06-05T15:59:44,825 adding 'moleculekit/share/pdb2pqr/residues/BB8.xml' 2024-06-05T15:59:44,826 adding 'moleculekit/share/pdb2pqr/residues/BCS.dat' 2024-06-05T15:59:44,827 adding 'moleculekit/share/pdb2pqr/residues/BCS.xml' 2024-06-05T15:59:44,828 adding 'moleculekit/share/pdb2pqr/residues/BTK.dat' 2024-06-05T15:59:44,830 adding 'moleculekit/share/pdb2pqr/residues/BTK.xml' 2024-06-05T15:59:44,831 adding 'moleculekit/share/pdb2pqr/residues/CCS.dat' 2024-06-05T15:59:44,832 adding 'moleculekit/share/pdb2pqr/residues/CCS.xml' 2024-06-05T15:59:44,834 adding 'moleculekit/share/pdb2pqr/residues/CGU.dat' 2024-06-05T15:59:44,835 adding 'moleculekit/share/pdb2pqr/residues/CGU.xml' 2024-06-05T15:59:44,836 adding 'moleculekit/share/pdb2pqr/residues/CSA.dat' 2024-06-05T15:59:44,837 adding 'moleculekit/share/pdb2pqr/residues/CSA.xml' 2024-06-05T15:59:44,839 adding 'moleculekit/share/pdb2pqr/residues/CSO.dat' 2024-06-05T15:59:44,840 adding 'moleculekit/share/pdb2pqr/residues/CSO.xml' 2024-06-05T15:59:44,841 adding 'moleculekit/share/pdb2pqr/residues/CSP.dat' 2024-06-05T15:59:44,842 adding 'moleculekit/share/pdb2pqr/residues/CSP.xml' 2024-06-05T15:59:44,843 adding 'moleculekit/share/pdb2pqr/residues/CSS.dat' 2024-06-05T15:59:44,845 adding 'moleculekit/share/pdb2pqr/residues/CSS.xml' 2024-06-05T15:59:44,846 adding 'moleculekit/share/pdb2pqr/residues/D4P.dat' 2024-06-05T15:59:44,847 adding 'moleculekit/share/pdb2pqr/residues/D4P.xml' 2024-06-05T15:59:44,848 adding 'moleculekit/share/pdb2pqr/residues/DA2.dat' 2024-06-05T15:59:44,849 adding 'moleculekit/share/pdb2pqr/residues/DA2.xml' 2024-06-05T15:59:44,851 adding 'moleculekit/share/pdb2pqr/residues/DAB.dat' 2024-06-05T15:59:44,852 adding 'moleculekit/share/pdb2pqr/residues/DAB.xml' 2024-06-05T15:59:44,853 adding 'moleculekit/share/pdb2pqr/residues/DAH.dat' 2024-06-05T15:59:44,854 adding 'moleculekit/share/pdb2pqr/residues/DAH.xml' 2024-06-05T15:59:44,856 adding 'moleculekit/share/pdb2pqr/residues/DPP.dat' 2024-06-05T15:59:44,857 adding 'moleculekit/share/pdb2pqr/residues/DPP.xml' 2024-06-05T15:59:44,858 adding 'moleculekit/share/pdb2pqr/residues/ESC.dat' 2024-06-05T15:59:44,859 adding 'moleculekit/share/pdb2pqr/residues/ESC.xml' 2024-06-05T15:59:44,860 adding 'moleculekit/share/pdb2pqr/residues/FGL.dat' 2024-06-05T15:59:44,861 adding 'moleculekit/share/pdb2pqr/residues/FGL.xml' 2024-06-05T15:59:44,863 adding 'moleculekit/share/pdb2pqr/residues/GHG.dat' 2024-06-05T15:59:44,864 adding 'moleculekit/share/pdb2pqr/residues/GHG.xml' 2024-06-05T15:59:44,865 adding 'moleculekit/share/pdb2pqr/residues/GME.dat' 2024-06-05T15:59:44,866 adding 'moleculekit/share/pdb2pqr/residues/GME.xml' 2024-06-05T15:59:44,868 adding 'moleculekit/share/pdb2pqr/residues/GNC.dat' 2024-06-05T15:59:44,869 adding 'moleculekit/share/pdb2pqr/residues/GNC.xml' 2024-06-05T15:59:44,870 adding 'moleculekit/share/pdb2pqr/residues/HHK.dat' 2024-06-05T15:59:44,871 adding 'moleculekit/share/pdb2pqr/residues/HHK.xml' 2024-06-05T15:59:44,872 adding 'moleculekit/share/pdb2pqr/residues/HLU.dat' 2024-06-05T15:59:44,874 adding 'moleculekit/share/pdb2pqr/residues/HLU.xml' 2024-06-05T15:59:44,875 adding 'moleculekit/share/pdb2pqr/residues/HLX.dat' 2024-06-05T15:59:44,876 adding 'moleculekit/share/pdb2pqr/residues/HLX.xml' 2024-06-05T15:59:44,877 adding 'moleculekit/share/pdb2pqr/residues/HOX.dat' 2024-06-05T15:59:44,879 adding 'moleculekit/share/pdb2pqr/residues/HOX.xml' 2024-06-05T15:59:44,880 adding 'moleculekit/share/pdb2pqr/residues/HPE.dat' 2024-06-05T15:59:44,881 adding 'moleculekit/share/pdb2pqr/residues/HPE.xml' 2024-06-05T15:59:44,882 adding 'moleculekit/share/pdb2pqr/residues/HQA.dat' 2024-06-05T15:59:44,884 adding 'moleculekit/share/pdb2pqr/residues/HQA.xml' 2024-06-05T15:59:44,885 adding 'moleculekit/share/pdb2pqr/residues/HTR.dat' 2024-06-05T15:59:44,886 adding 'moleculekit/share/pdb2pqr/residues/HTR.xml' 2024-06-05T15:59:44,887 adding 'moleculekit/share/pdb2pqr/residues/HYP.dat' 2024-06-05T15:59:44,889 adding 'moleculekit/share/pdb2pqr/residues/HYP.xml' 2024-06-05T15:59:44,890 adding 'moleculekit/share/pdb2pqr/residues/I2M.dat' 2024-06-05T15:59:44,891 adding 'moleculekit/share/pdb2pqr/residues/I2M.xml' 2024-06-05T15:59:44,892 adding 'moleculekit/share/pdb2pqr/residues/IGL.dat' 2024-06-05T15:59:44,893 adding 'moleculekit/share/pdb2pqr/residues/IGL.xml' 2024-06-05T15:59:44,895 adding 'moleculekit/share/pdb2pqr/residues/IIL.dat' 2024-06-05T15:59:44,896 adding 'moleculekit/share/pdb2pqr/residues/IIL.xml' 2024-06-05T15:59:44,897 adding 'moleculekit/share/pdb2pqr/residues/IML.dat' 2024-06-05T15:59:44,899 adding 'moleculekit/share/pdb2pqr/residues/IML.xml' 2024-06-05T15:59:44,900 adding 'moleculekit/share/pdb2pqr/residues/KYN.dat' 2024-06-05T15:59:44,901 adding 'moleculekit/share/pdb2pqr/residues/KYN.xml' 2024-06-05T15:59:44,902 adding 'moleculekit/share/pdb2pqr/residues/LME.dat' 2024-06-05T15:59:44,904 adding 'moleculekit/share/pdb2pqr/residues/LME.xml' 2024-06-05T15:59:44,905 adding 'moleculekit/share/pdb2pqr/residues/LMQ.dat' 2024-06-05T15:59:44,906 adding 'moleculekit/share/pdb2pqr/residues/LMQ.xml' 2024-06-05T15:59:44,907 adding 'moleculekit/share/pdb2pqr/residues/LYZ.dat' 2024-06-05T15:59:44,908 adding 'moleculekit/share/pdb2pqr/residues/LYZ.xml' 2024-06-05T15:59:44,910 adding 'moleculekit/share/pdb2pqr/residues/M3L.dat' 2024-06-05T15:59:44,911 adding 'moleculekit/share/pdb2pqr/residues/M3L.xml' 2024-06-05T15:59:44,912 adding 'moleculekit/share/pdb2pqr/residues/ME0.dat' 2024-06-05T15:59:44,914 adding 'moleculekit/share/pdb2pqr/residues/ME0.xml' 2024-06-05T15:59:44,915 adding 'moleculekit/share/pdb2pqr/residues/MEA.dat' 2024-06-05T15:59:44,916 adding 'moleculekit/share/pdb2pqr/residues/MEA.xml' 2024-06-05T15:59:44,917 adding 'moleculekit/share/pdb2pqr/residues/MEN.dat' 2024-06-05T15:59:44,919 adding 'moleculekit/share/pdb2pqr/residues/MEN.xml' 2024-06-05T15:59:44,920 adding 'moleculekit/share/pdb2pqr/residues/MEQ.dat' 2024-06-05T15:59:44,921 adding 'moleculekit/share/pdb2pqr/residues/MEQ.xml' 2024-06-05T15:59:44,922 adding 'moleculekit/share/pdb2pqr/residues/MLE.dat' 2024-06-05T15:59:44,924 adding 'moleculekit/share/pdb2pqr/residues/MLE.xml' 2024-06-05T15:59:44,925 adding 'moleculekit/share/pdb2pqr/residues/MLY.dat' 2024-06-05T15:59:44,926 adding 'moleculekit/share/pdb2pqr/residues/MLY.xml' 2024-06-05T15:59:44,927 adding 'moleculekit/share/pdb2pqr/residues/MLZ.dat' 2024-06-05T15:59:44,929 adding 'moleculekit/share/pdb2pqr/residues/MLZ.xml' 2024-06-05T15:59:44,930 adding 'moleculekit/share/pdb2pqr/residues/MME.dat' 2024-06-05T15:59:44,931 adding 'moleculekit/share/pdb2pqr/residues/MME.xml' 2024-06-05T15:59:44,932 adding 'moleculekit/share/pdb2pqr/residues/MMO.dat' 2024-06-05T15:59:44,934 adding 'moleculekit/share/pdb2pqr/residues/MMO.xml' 2024-06-05T15:59:44,935 adding 'moleculekit/share/pdb2pqr/residues/MVA.dat' 2024-06-05T15:59:44,936 adding 'moleculekit/share/pdb2pqr/residues/MVA.xml' 2024-06-05T15:59:44,937 adding 'moleculekit/share/pdb2pqr/residues/NAL.dat' 2024-06-05T15:59:44,939 adding 'moleculekit/share/pdb2pqr/residues/NAL.xml' 2024-06-05T15:59:44,940 adding 'moleculekit/share/pdb2pqr/residues/NCY.dat' 2024-06-05T15:59:44,941 adding 'moleculekit/share/pdb2pqr/residues/NCY.xml' 2024-06-05T15:59:44,942 adding 'moleculekit/share/pdb2pqr/residues/NLE.dat' 2024-06-05T15:59:44,943 adding 'moleculekit/share/pdb2pqr/residues/NLE.xml' 2024-06-05T15:59:44,945 adding 'moleculekit/share/pdb2pqr/residues/NVA.dat' 2024-06-05T15:59:44,946 adding 'moleculekit/share/pdb2pqr/residues/NVA.xml' 2024-06-05T15:59:44,947 adding 'moleculekit/share/pdb2pqr/residues/NZC.dat' 2024-06-05T15:59:44,948 adding 'moleculekit/share/pdb2pqr/residues/NZC.xml' 2024-06-05T15:59:44,949 adding 'moleculekit/share/pdb2pqr/residues/OCY.dat' 2024-06-05T15:59:44,951 adding 'moleculekit/share/pdb2pqr/residues/OCY.xml' 2024-06-05T15:59:44,952 adding 'moleculekit/share/pdb2pqr/residues/OMX.dat' 2024-06-05T15:59:44,953 adding 'moleculekit/share/pdb2pqr/residues/OMX.xml' 2024-06-05T15:59:44,954 adding 'moleculekit/share/pdb2pqr/residues/ONL.dat' 2024-06-05T15:59:44,956 adding 'moleculekit/share/pdb2pqr/residues/ONL.xml' 2024-06-05T15:59:44,957 adding 'moleculekit/share/pdb2pqr/residues/ORM.dat' 2024-06-05T15:59:44,958 adding 'moleculekit/share/pdb2pqr/residues/ORM.xml' 2024-06-05T15:59:44,959 adding 'moleculekit/share/pdb2pqr/residues/P1L.dat' 2024-06-05T15:59:44,961 adding 'moleculekit/share/pdb2pqr/residues/P1L.xml' 2024-06-05T15:59:44,962 adding 'moleculekit/share/pdb2pqr/residues/PCA.dat' 2024-06-05T15:59:44,963 adding 'moleculekit/share/pdb2pqr/residues/PCA.xml' 2024-06-05T15:59:44,964 adding 'moleculekit/share/pdb2pqr/residues/PRK.dat' 2024-06-05T15:59:44,966 adding 'moleculekit/share/pdb2pqr/residues/PRK.xml' 2024-06-05T15:59:44,967 adding 'moleculekit/share/pdb2pqr/residues/PTR.dat' 2024-06-05T15:59:44,968 adding 'moleculekit/share/pdb2pqr/residues/PTR.xml' 2024-06-05T15:59:44,969 adding 'moleculekit/share/pdb2pqr/residues/SEP.dat' 2024-06-05T15:59:44,971 adding 'moleculekit/share/pdb2pqr/residues/SEP.xml' 2024-06-05T15:59:44,972 adding 'moleculekit/share/pdb2pqr/residues/TPO.dat' 2024-06-05T15:59:44,973 adding 'moleculekit/share/pdb2pqr/residues/TPO.xml' 2024-06-05T15:59:44,974 adding 'moleculekit/share/pdb2pqr/residues/TRO.dat' 2024-06-05T15:59:44,976 adding 'moleculekit/share/pdb2pqr/residues/TRO.xml' 2024-06-05T15:59:44,977 adding 'moleculekit/share/pdb2pqr/residues/TY2.dat' 2024-06-05T15:59:44,978 adding 'moleculekit/share/pdb2pqr/residues/TY2.xml' 2024-06-05T15:59:44,980 adding 'moleculekit/share/pdb2pqr/residues/TYQ.dat' 2024-06-05T15:59:44,981 adding 'moleculekit/share/pdb2pqr/residues/TYQ.xml' 2024-06-05T15:59:44,982 adding 'moleculekit/share/pdb2pqr/residues/YCM.dat' 2024-06-05T15:59:44,984 adding 'moleculekit/share/pdb2pqr/residues/YCM.xml' 2024-06-05T15:59:44,985 adding 'moleculekit/share/pdb2pqr/residues/YNM.dat' 2024-06-05T15:59:44,986 adding 'moleculekit/share/pdb2pqr/residues/YNM.xml' 2024-06-05T15:59:44,988 adding 'moleculekit/smallmol/__init__.py' 2024-06-05T15:59:44,993 adding 'moleculekit/smallmol/smallmol.py' 2024-06-05T15:59:44,995 adding 'moleculekit/smallmol/smallmolcdp.py' 2024-06-05T15:59:44,998 adding 'moleculekit/smallmol/smallmollib.py' 2024-06-05T15:59:44,999 adding 'moleculekit/smallmol/test_smallmol.py' 2024-06-05T15:59:45,001 adding 'moleculekit/smallmol/test_smallmollib.py' 2024-06-05T15:59:45,003 adding 'moleculekit/smallmol/util.py' 2024-06-05T15:59:45,005 adding 'moleculekit/smallmol/tools/__init__.py' 2024-06-05T15:59:45,007 adding 'moleculekit/smallmol/tools/clustering.py' 2024-06-05T15:59:45,008 adding 'moleculekit/smallmol/tools/restrainedembed.py' 2024-06-05T15:59:45,010 adding 'moleculekit/smallmol/tools/test_tools.py' 2024-06-05T15:59:45,101 adding 'moleculekit/tmalign/tmalign_util.cpp' 2024-06-05T15:59:45,110 adding 'moleculekit/tmalign/tmalign_util.pyx' 2024-06-05T15:59:45,111 adding 'moleculekit/tmalign/tmalignlib.pxd' 2024-06-05T15:59:45,113 adding 'moleculekit/tmalign/include/TMAlign.h' 2024-06-05T15:59:45,131 adding 'moleculekit/tmalign/src/TMAlign.cpp' 2024-06-05T15:59:45,134 adding 'moleculekit/tools/__init__.py' 2024-06-05T15:59:45,136 adding 'moleculekit/tools/atomtyper.py' 2024-06-05T15:59:45,138 adding 'moleculekit/tools/autosegment.py' 2024-06-05T15:59:45,140 adding 'moleculekit/tools/crystalpacking.py' 2024-06-05T15:59:45,144 adding 'moleculekit/tools/detect.py' 2024-06-05T15:59:45,146 adding 'moleculekit/tools/docking.py' 2024-06-05T15:59:45,147 adding 'moleculekit/tools/graphalignment.py' 2024-06-05T15:59:45,149 adding 'moleculekit/tools/hhblitsprofile.py' 2024-06-05T15:59:45,150 adding 'moleculekit/tools/modelling.py' 2024-06-05T15:59:45,152 adding 'moleculekit/tools/moleculechecks.py' 2024-06-05T15:59:45,158 adding 'moleculekit/tools/preparation.py' 2024-06-05T15:59:45,161 adding 'moleculekit/tools/preparation_customres.py' 2024-06-05T15:59:45,163 adding 'moleculekit/tools/sequencestructuralalignment.py' 2024-06-05T15:59:45,166 adding 'moleculekit/tools/voxeldescriptors.py' 2024-06-05T15:59:45,168 adding 'moleculekit/tools/obabel_tools/__init__.py' 2024-06-05T15:59:45,169 adding 'moleculekit/tools/obabel_tools/obabel_cli.py' 2024-06-05T15:59:45,262 adding 'moleculekit/wrapping/wrapping.cpp' 2024-06-05T15:59:45,271 adding 'moleculekit/wrapping/wrapping.pyx' 2024-06-05T15:59:45,274 adding 'moleculekit-1.8.33.dist-info/LICENSE' 2024-06-05T15:59:45,275 adding 'moleculekit-1.8.33.dist-info/METADATA' 2024-06-05T15:59:45,276 adding 'moleculekit-1.8.33.dist-info/WHEEL' 2024-06-05T15:59:45,277 adding 'moleculekit-1.8.33.dist-info/top_level.txt' 2024-06-05T15:59:45,283 adding 'moleculekit-1.8.33.dist-info/RECORD' 2024-06-05T15:59:45,581 removing build/bdist.linux-armv7l/wheel 2024-06-05T15:59:45,874 Building wheel for moleculekit (pyproject.toml): finished with status 'done' 2024-06-05T15:59:46,211 Created wheel for moleculekit: filename=moleculekit-1.8.33-cp39-cp39-linux_armv7l.whl size=14905261 sha256=3d6bb5aa26d1b0395385d5f79f151e71fc73ec74703c4bcd649823311c63a46d 2024-06-05T15:59:46,212 Stored in directory: /tmp/pip-ephem-wheel-cache-pg2_ttvo/wheels/14/48/b6/559d548622bb6b2e2e0c19180df304cda4b15bfe1b8c39b15d 2024-06-05T15:59:46,250 Successfully built moleculekit 2024-06-05T15:59:46,653 Removed build tracker: '/tmp/pip-build-tracker-zn9uxige'