2023-10-17T18:22:22,916 Created temporary directory: /tmp/pip-build-tracker-c2as3i3r 2023-10-17T18:22:22,918 Initialized build tracking at /tmp/pip-build-tracker-c2as3i3r 2023-10-17T18:22:22,918 Created build tracker: /tmp/pip-build-tracker-c2as3i3r 2023-10-17T18:22:22,918 Entered build tracker: /tmp/pip-build-tracker-c2as3i3r 2023-10-17T18:22:22,919 Created temporary directory: /tmp/pip-wheel-4q_r2z82 2023-10-17T18:22:22,923 Created temporary directory: /tmp/pip-ephem-wheel-cache-ki4j991m 2023-10-17T18:22:22,947 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2023-10-17T18:22:22,950 2 location(s) to search for versions of moleculekit: 2023-10-17T18:22:22,950 * https://pypi.org/simple/moleculekit/ 2023-10-17T18:22:22,950 * https://www.piwheels.org/simple/moleculekit/ 2023-10-17T18:22:22,951 Fetching project page and analyzing links: https://pypi.org/simple/moleculekit/ 2023-10-17T18:22:22,951 Getting page https://pypi.org/simple/moleculekit/ 2023-10-17T18:22:22,953 Found index url https://pypi.org/simple/ 2023-10-17T18:22:23,011 Fetched page https://pypi.org/simple/moleculekit/ as application/vnd.pypi.simple.v1+json 2023-10-17T18:22:23,050 Skipping link: No binaries permitted for moleculekit: https://files.pythonhosted.org/packages/91/e6/25b6853357dfef8a4026325e420d8213d34c17c078a2f13b60cbb6213ea3/moleculekit-0.1.4-py3-none-any.whl (from https://pypi.org/simple/moleculekit/) 2023-10-17T18:22:23,051 Found link https://files.pythonhosted.org/packages/13/0f/a200e8e7632d3a521cfc7c15fa4d0270802efce40f98ac5a5cae58385b7e/moleculekit-0.1.4.tar.gz (from https://pypi.org/simple/moleculekit/), version: 0.1.4 2023-10-17T18:22:23,051 Skipping link: No binaries permitted for moleculekit: https://files.pythonhosted.org/packages/9f/a5/eac32fcb2e9ff0d30298aa4cec8e152c95d675c4dd1a1a5d7676986d4d75/moleculekit-0.1.5-py3-none-any.whl (from https://pypi.org/simple/moleculekit/) 2023-10-17T18:22:23,051 Found link 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2023-10-17T18:22:23,118 Found link https://files.pythonhosted.org/packages/6f/4d/4a0e90a65d79829ae0bec8d857de2f8b7e18b6d60e05daa99cdbed0061c0/moleculekit-1.8.4.tar.gz (from https://pypi.org/simple/moleculekit/) (requires-python:>=3.8), version: 1.8.4 2023-10-17T18:22:23,118 Fetching project page and analyzing links: https://www.piwheels.org/simple/moleculekit/ 2023-10-17T18:22:23,119 Getting page https://www.piwheels.org/simple/moleculekit/ 2023-10-17T18:22:23,120 Found index url https://www.piwheels.org/simple/ 2023-10-17T18:22:23,195 Fetched page https://www.piwheels.org/simple/moleculekit/ as text/html 2023-10-17T18:22:23,267 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-1.8.4-cp311-cp311-linux_armv7l.whl#sha256=80595e5496b482f9f33e8f60f1035b76b64fa155f33895fc1a17245ab6099dd0 (from https://www.piwheels.org/simple/moleculekit/) (requires-python:>=3.8) 2023-10-17T18:22:23,268 Skipping link: No binaries permitted for 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(from https://www.piwheels.org/simple/moleculekit/) 2023-10-17T18:22:23,316 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.17-py3-none-any.whl#sha256=cd99998c6c3ee48df7148cec7161f3696beede842d4e93bb9da19fa9e2c6c459 (from https://www.piwheels.org/simple/moleculekit/) 2023-10-17T18:22:23,316 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.16-py3-none-any.whl#sha256=8045990a2fc7c805a4ab8244abe9eae67ac92495cbce12f1c9e8b0daa26a77b1 (from https://www.piwheels.org/simple/moleculekit/) 2023-10-17T18:22:23,316 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.15-py3-none-any.whl#sha256=4db5d8b5350b36ce41d225c471f0fdd64f708826935ac50675fb278c00275339 (from https://www.piwheels.org/simple/moleculekit/) 2023-10-17T18:22:23,316 Skipping link: No binaries permitted for moleculekit: 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(from https://www.piwheels.org/simple/moleculekit/) 2023-10-17T18:22:23,317 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.7-py3-none-any.whl#sha256=899ef09b80e1ad2e3931cb2023fae09cfeecd45b83fade6c8e8739126ca67a20 (from https://www.piwheels.org/simple/moleculekit/) 2023-10-17T18:22:23,317 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.6-py3-none-any.whl#sha256=0a288cd1efd660482dcc967caed02315dd8f02c19a0287eee0b8519d761db1b3 (from https://www.piwheels.org/simple/moleculekit/) 2023-10-17T18:22:23,317 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.5-py3-none-any.whl#sha256=2f111e31b3f90e63ca0154c528585208b8bd41a065aa0078325683f4b36eacec (from https://www.piwheels.org/simple/moleculekit/) 2023-10-17T18:22:23,318 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.4-py3-none-any.whl#sha256=5784491ff294e145a00311f8239aaa0b92c12605db0508ee3e10469b80d4cadd (from https://www.piwheels.org/simple/moleculekit/) 2023-10-17T18:22:23,318 Skipping link: not a file: https://www.piwheels.org/simple/moleculekit/ 2023-10-17T18:22:23,318 Skipping link: not a file: https://pypi.org/simple/moleculekit/ 2023-10-17T18:22:23,360 Given no hashes to check 1 links for project 'moleculekit': discarding no candidates 2023-10-17T18:22:23,378 Collecting moleculekit==1.8.3 2023-10-17T18:22:23,380 Created temporary directory: /tmp/pip-unpack-fvck4gsc 2023-10-17T18:22:23,427 Downloading moleculekit-1.8.3.tar.gz (6.2 MB) 2023-10-17T18:22:25,412 Added moleculekit==1.8.3 from https://files.pythonhosted.org/packages/23/e8/3ebe2bfb667296b1c79d4e59fdfb487116bfd8bec579ca242eec7ecad0c2/moleculekit-1.8.3.tar.gz to build tracker '/tmp/pip-build-tracker-c2as3i3r' 2023-10-17T18:22:25,420 Created temporary directory: /tmp/pip-build-env-2lr9d234 2023-10-17T18:22:25,430 Installing build dependencies: started 2023-10-17T18:22:25,431 Running command pip subprocess to install build dependencies 2023-10-17T18:22:26,612 Using pip 23.2.1 from /usr/local/lib/python3.9/dist-packages/pip (python 3.9) 2023-10-17T18:22:27,628 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2023-10-17T18:22:29,455 Collecting setuptools 2023-10-17T18:22:29,544 Using cached https://www.piwheels.org/simple/setuptools/setuptools-68.2.2-py3-none-any.whl (807 kB) 2023-10-17T18:22:30,935 Collecting numpy>=1.18.5 2023-10-17T18:22:32,254 Using cached https://www.piwheels.org/simple/numpy/numpy-1.26.1-cp39-cp39-linux_armv7l.whl (19.4 MB) 2023-10-17T18:22:34,520 Collecting Cython>=0.29.21 2023-10-17T18:22:35,297 Using cached https://www.piwheels.org/simple/cython/Cython-3.0.3-cp39-cp39-linux_armv7l.whl (10.7 MB) 2023-10-17T18:22:35,664 Collecting toml 2023-10-17T18:22:35,681 Using cached https://www.piwheels.org/simple/toml/toml-0.10.2-py2.py3-none-any.whl (16 kB) 2023-10-17T18:22:35,865 Collecting versioneer[toml]==0.28 2023-10-17T18:22:35,885 Using cached https://www.piwheels.org/simple/versioneer/versioneer-0.28-py3-none-any.whl (45 kB) 2023-10-17T18:22:36,014 Collecting tomli (from versioneer[toml]==0.28) 2023-10-17T18:22:36,029 Using cached https://www.piwheels.org/simple/tomli/tomli-2.0.1-py3-none-any.whl (12 kB) 2023-10-17T18:22:37,800 Installing collected packages: versioneer, tomli, toml, setuptools, numpy, Cython 2023-10-17T18:22:37,835 Creating /tmp/pip-build-env-2lr9d234/overlay/bin 2023-10-17T18:22:37,838 changing mode of /tmp/pip-build-env-2lr9d234/overlay/bin/versioneer to 755 2023-10-17T18:22:47,802 changing mode of /tmp/pip-build-env-2lr9d234/overlay/bin/f2py to 755 2023-10-17T18:22:51,255 changing mode of /tmp/pip-build-env-2lr9d234/overlay/bin/cygdb to 755 2023-10-17T18:22:51,257 changing mode of /tmp/pip-build-env-2lr9d234/overlay/bin/cython to 755 2023-10-17T18:22:51,259 changing mode of /tmp/pip-build-env-2lr9d234/overlay/bin/cythonize to 755 2023-10-17T18:22:51,283 ERROR: pip's dependency resolver does not currently take into account all the packages that are installed. This behaviour is the source of the following dependency conflicts. 2023-10-17T18:22:51,284 scipy 1.8.1 requires numpy<1.25.0,>=1.17.3, but you have numpy 1.26.1 which is incompatible. 2023-10-17T18:22:51,284 Successfully installed Cython-3.0.3 numpy-1.26.1 setuptools-68.2.2 toml-0.10.2 tomli-2.0.1 versioneer-0.28 2023-10-17T18:22:51,481 [notice] A new release of pip is available: 23.2.1 -> 23.3 2023-10-17T18:22:51,481 [notice] To update, run: python3 -m pip install --upgrade pip 2023-10-17T18:22:51,897 Installing build dependencies: finished with status 'done' 2023-10-17T18:22:51,901 Getting requirements to build wheel: started 2023-10-17T18:22:51,902 Running command Getting requirements to build wheel 2023-10-17T18:23:30,324 Compiling moleculekit/interactions/hbonds/hbonds.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2023-10-17T18:23:30,325 Compiling moleculekit/interactions/pipi/pipi.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2023-10-17T18:23:30,325 Compiling moleculekit/interactions/cationpi/cationpi.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2023-10-17T18:23:30,325 Compiling moleculekit/interactions/sigmahole/sigmahole.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2023-10-17T18:23:30,325 Compiling moleculekit/wrapping/wrapping.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2023-10-17T18:23:30,325 Compiling moleculekit/bondguesser_utils/bondguesser_utils.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2023-10-17T18:23:30,325 Compiling moleculekit/atomselect_utils/atomselect_utils.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2023-10-17T18:23:30,325 Compiling moleculekit/distance_utils/distance_utils.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2023-10-17T18:23:30,326 Compiling moleculekit/occupancy_utils/occupancy_utils.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2023-10-17T18:23:30,326 Compiling moleculekit/xtc_utils/xtc.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2023-10-17T18:23:30,326 Compiling moleculekit/tmalign/tmalign_util.pyx because it depends on /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2023-10-17T18:23:30,326 [ 1/11] Cythonizing moleculekit/atomselect_utils/atomselect_utils.pyx 2023-10-17T18:23:30,326 [ 2/11] Cythonizing moleculekit/bondguesser_utils/bondguesser_utils.pyx 2023-10-17T18:23:30,326 [ 3/11] Cythonizing moleculekit/distance_utils/distance_utils.pyx 2023-10-17T18:23:30,326 [ 4/11] Cythonizing moleculekit/interactions/cationpi/cationpi.pyx 2023-10-17T18:23:30,326 [ 5/11] Cythonizing moleculekit/interactions/hbonds/hbonds.pyx 2023-10-17T18:23:30,326 [ 6/11] Cythonizing moleculekit/interactions/pipi/pipi.pyx 2023-10-17T18:23:30,327 [ 7/11] Cythonizing moleculekit/interactions/sigmahole/sigmahole.pyx 2023-10-17T18:23:30,327 [ 8/11] Cythonizing moleculekit/occupancy_utils/occupancy_utils.pyx 2023-10-17T18:23:30,327 [ 9/11] Cythonizing moleculekit/tmalign/tmalign_util.pyx 2023-10-17T18:23:30,327 [10/11] Cythonizing moleculekit/wrapping/wrapping.pyx 2023-10-17T18:23:30,327 [11/11] Cythonizing moleculekit/xtc_utils/xtc.pyx 2023-10-17T18:23:30,603 running egg_info 2023-10-17T18:23:30,609 writing moleculekit.egg-info/PKG-INFO 2023-10-17T18:23:30,612 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2023-10-17T18:23:30,614 writing requirements to moleculekit.egg-info/requires.txt 2023-10-17T18:23:30,615 writing top-level names to moleculekit.egg-info/top_level.txt 2023-10-17T18:23:30,638 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,638 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,639 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,639 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,639 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,639 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,639 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,639 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,639 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,640 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,640 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,640 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,640 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,640 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,640 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,640 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,641 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,641 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,641 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,641 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,641 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,641 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,641 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,642 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,642 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,642 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,642 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,642 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,642 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,642 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:30,642 dependency 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'moleculekit.egg-info/SOURCES.txt' 2023-10-17T18:23:31,863 Getting requirements to build wheel: finished with status 'done' 2023-10-17T18:23:31,881 Installing backend dependencies: started 2023-10-17T18:23:31,882 Running command pip subprocess to install backend dependencies 2023-10-17T18:23:33,170 Using pip 23.2.1 from /usr/local/lib/python3.9/dist-packages/pip (python 3.9) 2023-10-17T18:23:33,750 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2023-10-17T18:23:34,111 Collecting wheel 2023-10-17T18:23:34,131 Using cached https://www.piwheels.org/simple/wheel/wheel-0.41.2-py3-none-any.whl (64 kB) 2023-10-17T18:23:35,487 Installing collected packages: wheel 2023-10-17T18:23:35,716 Creating /tmp/pip-build-env-2lr9d234/normal/bin 2023-10-17T18:23:35,718 changing mode of /tmp/pip-build-env-2lr9d234/normal/bin/wheel to 755 2023-10-17T18:23:35,732 Successfully installed wheel-0.41.2 2023-10-17T18:23:35,926 [notice] A new release of pip is available: 23.2.1 -> 23.3 2023-10-17T18:23:35,926 [notice] To update, run: python3 -m pip install --upgrade pip 2023-10-17T18:23:36,141 Installing backend dependencies: finished with status 'done' 2023-10-17T18:23:36,143 Created temporary directory: /tmp/pip-modern-metadata-f9r7j9q2 2023-10-17T18:23:36,146 Preparing metadata (pyproject.toml): started 2023-10-17T18:23:36,147 Running command Preparing metadata (pyproject.toml) 2023-10-17T18:23:38,526 running dist_info 2023-10-17T18:23:38,528 creating /tmp/pip-modern-metadata-f9r7j9q2/moleculekit.egg-info 2023-10-17T18:23:38,534 writing /tmp/pip-modern-metadata-f9r7j9q2/moleculekit.egg-info/PKG-INFO 2023-10-17T18:23:38,538 writing dependency_links to /tmp/pip-modern-metadata-f9r7j9q2/moleculekit.egg-info/dependency_links.txt 2023-10-17T18:23:38,540 writing requirements to /tmp/pip-modern-metadata-f9r7j9q2/moleculekit.egg-info/requires.txt 2023-10-17T18:23:38,541 writing top-level names to /tmp/pip-modern-metadata-f9r7j9q2/moleculekit.egg-info/top_level.txt 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manifest: the path must be relative 2023-10-17T18:23:38,574 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:38,580 reading manifest file '/tmp/pip-modern-metadata-f9r7j9q2/moleculekit.egg-info/SOURCES.txt' 2023-10-17T18:23:38,582 reading manifest template 'MANIFEST.in' 2023-10-17T18:23:38,806 no previously-included directories found matching 'moleculekit/test-data' 2023-10-17T18:23:38,807 no previously-included directories found matching 'moleculekit/tests' 2023-10-17T18:23:38,807 no previously-included directories found matching 'package' 2023-10-17T18:23:38,808 adding license file 'LICENSE' 2023-10-17T18:23:38,820 writing manifest file '/tmp/pip-modern-metadata-f9r7j9q2/moleculekit.egg-info/SOURCES.txt' 2023-10-17T18:23:38,828 creating '/tmp/pip-modern-metadata-f9r7j9q2/moleculekit-1.8.3.dist-info' 2023-10-17T18:23:39,026 Preparing metadata (pyproject.toml): finished with status 'done' 2023-10-17T18:23:39,032 Source in /tmp/pip-wheel-4q_r2z82/moleculekit_49b558f9a84a47fa9ff5fff1998494ff has version 1.8.3, which satisfies requirement moleculekit==1.8.3 from https://files.pythonhosted.org/packages/23/e8/3ebe2bfb667296b1c79d4e59fdfb487116bfd8bec579ca242eec7ecad0c2/moleculekit-1.8.3.tar.gz 2023-10-17T18:23:39,033 Removed moleculekit==1.8.3 from https://files.pythonhosted.org/packages/23/e8/3ebe2bfb667296b1c79d4e59fdfb487116bfd8bec579ca242eec7ecad0c2/moleculekit-1.8.3.tar.gz from build tracker '/tmp/pip-build-tracker-c2as3i3r' 2023-10-17T18:23:39,039 Created temporary directory: /tmp/pip-unpack-seq1qw3g 2023-10-17T18:23:39,040 Created temporary directory: /tmp/pip-unpack-5llt4cj9 2023-10-17T18:23:39,048 Building wheels for collected packages: moleculekit 2023-10-17T18:23:39,052 Created temporary directory: /tmp/pip-wheel-0u2zlg70 2023-10-17T18:23:39,053 Destination directory: /tmp/pip-wheel-0u2zlg70 2023-10-17T18:23:39,055 Building wheel for moleculekit (pyproject.toml): started 2023-10-17T18:23:39,056 Running command Building wheel for moleculekit (pyproject.toml) 2023-10-17T18:23:41,510 running bdist_wheel 2023-10-17T18:23:41,527 running build 2023-10-17T18:23:41,527 running build_py 2023-10-17T18:23:41,535 creating build 2023-10-17T18:23:41,535 creating build/lib.linux-armv7l-cpython-39 2023-10-17T18:23:41,536 creating build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,537 copying moleculekit/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,540 copying moleculekit/version.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,542 copying moleculekit/home.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,543 copying moleculekit/viewer.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,545 copying moleculekit/dihedral.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,547 copying moleculekit/distance.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,548 copying moleculekit/align.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,551 copying moleculekit/_version.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,552 copying moleculekit/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,554 copying moleculekit/periodictable.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,556 copying moleculekit/readers.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,564 copying moleculekit/rcsb.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,566 copying moleculekit/bondguesser.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,568 copying moleculekit/config.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,570 copying moleculekit/opm.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,573 copying moleculekit/rdkitintegration.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,574 copying moleculekit/vmdviewer.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,576 copying moleculekit/writers.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,579 copying moleculekit/molecule.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,584 copying moleculekit/pymolgraphics.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,586 copying moleculekit/vmdgraphics.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:41,589 creating build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,590 copying moleculekit/projections/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,592 copying moleculekit/projections/metricsasa.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,594 copying moleculekit/projections/metricsphericalcoordinate.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,597 copying moleculekit/projections/metricsecondarystructure.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,599 copying moleculekit/projections/metricfluctuation.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,601 copying moleculekit/projections/metricdistance.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,603 copying moleculekit/projections/metriccoordinate.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,606 copying moleculekit/projections/metricshell.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,608 copying moleculekit/projections/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,610 copying moleculekit/projections/metrictmscore.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,612 copying moleculekit/projections/metricrmsd.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,614 copying moleculekit/projections/metricdihedral.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,618 copying moleculekit/projections/metricplumed2.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,620 copying moleculekit/projections/metricgyration.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,623 copying moleculekit/projections/projection.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2023-10-17T18:23:41,625 creating build/lib.linux-armv7l-cpython-39/moleculekit/ply 2023-10-17T18:23:41,626 copying moleculekit/ply/yacc.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2023-10-17T18:23:41,629 copying moleculekit/ply/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2023-10-17T18:23:41,631 copying moleculekit/ply/lex.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2023-10-17T18:23:41,634 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2023-10-17T18:23:41,635 copying moleculekit/interactions/interactions.py -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2023-10-17T18:23:41,638 copying moleculekit/interactions/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2023-10-17T18:23:41,640 creating build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2023-10-17T18:23:41,641 copying moleculekit/atomselect/analyze.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2023-10-17T18:23:41,643 copying moleculekit/atomselect/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2023-10-17T18:23:41,645 copying moleculekit/atomselect/atomselect.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2023-10-17T18:23:41,647 copying moleculekit/atomselect/languageparser.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2023-10-17T18:23:41,650 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx 2023-10-17T18:23:41,650 copying moleculekit/pdbx/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx 2023-10-17T18:23:41,653 creating build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2023-10-17T18:23:41,653 copying moleculekit/smallmol/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2023-10-17T18:23:41,656 copying moleculekit/smallmol/test_smallmol.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2023-10-17T18:23:41,659 copying moleculekit/smallmol/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2023-10-17T18:23:41,661 copying moleculekit/smallmol/smallmollib.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2023-10-17T18:23:41,663 copying moleculekit/smallmol/test_smallmollib.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2023-10-17T18:23:41,665 copying moleculekit/smallmol/smallmol.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2023-10-17T18:23:41,669 creating build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,670 copying moleculekit/tools/preparation.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,673 copying moleculekit/tools/sequencestructuralalignment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,676 copying moleculekit/tools/preparation_customres.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,678 copying moleculekit/tools/docking.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,680 copying moleculekit/tools/voxeldescriptors.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,683 copying moleculekit/tools/atomtyper.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,685 copying moleculekit/tools/hhblitsprofile.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,687 copying moleculekit/tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,688 copying moleculekit/tools/crystalpacking.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,691 copying moleculekit/tools/graphalignment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,693 copying moleculekit/tools/detect.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,696 copying moleculekit/tools/moleculechecks.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,698 copying moleculekit/tools/autosegment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2023-10-17T18:23:41,701 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2023-10-17T18:23:41,702 copying moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2023-10-17T18:23:41,704 copying moleculekit/pdbx/tests/PdbxWriterTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2023-10-17T18:23:41,706 copying moleculekit/pdbx/tests/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2023-10-17T18:23:41,708 copying moleculekit/pdbx/tests/PdbxReaderTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2023-10-17T18:23:41,711 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2023-10-17T18:23:41,712 copying moleculekit/pdbx/reader/PdbxParser.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2023-10-17T18:23:41,715 copying moleculekit/pdbx/reader/PdbxContainers.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2023-10-17T18:23:41,718 copying moleculekit/pdbx/reader/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2023-10-17T18:23:41,719 copying moleculekit/pdbx/reader/PdbxReader.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2023-10-17T18:23:41,722 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2023-10-17T18:23:41,723 copying moleculekit/pdbx/writer/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2023-10-17T18:23:41,724 copying moleculekit/pdbx/writer/PdbxWriter.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2023-10-17T18:23:41,727 creating build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2023-10-17T18:23:41,728 copying moleculekit/smallmol/tools/clustering.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2023-10-17T18:23:41,730 copying moleculekit/smallmol/tools/restrainedembed.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2023-10-17T18:23:41,732 copying moleculekit/smallmol/tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2023-10-17T18:23:41,734 copying moleculekit/smallmol/tools/test_tools.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2023-10-17T18:23:41,737 creating build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2023-10-17T18:23:41,738 copying moleculekit/tools/obabel_tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2023-10-17T18:23:41,740 copying moleculekit/tools/obabel_tools/obabel_cli.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2023-10-17T18:23:41,741 running egg_info 2023-10-17T18:23:41,747 writing moleculekit.egg-info/PKG-INFO 2023-10-17T18:23:41,750 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2023-10-17T18:23:41,751 writing requirements to moleculekit.egg-info/requires.txt 2023-10-17T18:23:41,752 writing top-level names to moleculekit.egg-info/top_level.txt 2023-10-17T18:23:41,765 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,766 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,766 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,766 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,766 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,766 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,766 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,767 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,767 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,767 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,767 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,767 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,767 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,767 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,767 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,768 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,768 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,768 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,768 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,768 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,768 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,768 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,768 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,769 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,769 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,769 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,769 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,769 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,769 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,769 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,770 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,770 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,770 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,770 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,770 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,770 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,770 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,770 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,771 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,771 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,771 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,771 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,771 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,771 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,771 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,772 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,772 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,772 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,772 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,772 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,772 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,772 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,773 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,773 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,773 dependency /tmp/pip-build-env-2lr9d234/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 2023-10-17T18:23:41,779 reading manifest file 'moleculekit.egg-info/SOURCES.txt' 2023-10-17T18:23:41,788 reading manifest template 'MANIFEST.in' 2023-10-17T18:23:42,012 no previously-included directories found matching 'moleculekit/test-data' 2023-10-17T18:23:42,013 no previously-included directories found matching 'moleculekit/tests' 2023-10-17T18:23:42,014 no previously-included directories found matching 'package' 2023-10-17T18:23:42,014 adding license file 'LICENSE' 2023-10-17T18:23:42,031 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2023-10-17T18:23:42,041 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.atomselect_utils' is absent from the `packages` configuration. 2023-10-17T18:23:42,041 !! 2023-10-17T18:23:42,042 ******************************************************************************** 2023-10-17T18:23:42,042 ############################ 2023-10-17T18:23:42,042 # Package would be ignored # 2023-10-17T18:23:42,042 ############################ 2023-10-17T18:23:42,042 Python recognizes 'moleculekit.atomselect_utils' as an importable package[^1], 2023-10-17T18:23:42,042 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,042 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,043 package, please make sure that 'moleculekit.atomselect_utils' is explicitly added 2023-10-17T18:23:42,043 to the `packages` configuration field. 2023-10-17T18:23:42,043 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,043 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,043 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,043 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,044 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,044 If you don't want 'moleculekit.atomselect_utils' to be distributed and are 2023-10-17T18:23:42,044 already explicitly excluding 'moleculekit.atomselect_utils' via 2023-10-17T18:23:42,044 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,044 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,044 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,044 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,045 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,045 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,045 even if it does not contain any `.py` files. 2023-10-17T18:23:42,045 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,045 directory, all directories are treated like packages. 2023-10-17T18:23:42,046 ******************************************************************************** 2023-10-17T18:23:42,046 !! 2023-10-17T18:23:42,046 check.warn(importable) 2023-10-17T18:23:42,046 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.bondguesser_utils' is absent from the `packages` configuration. 2023-10-17T18:23:42,046 !! 2023-10-17T18:23:42,046 ******************************************************************************** 2023-10-17T18:23:42,047 ############################ 2023-10-17T18:23:42,047 # Package would be ignored # 2023-10-17T18:23:42,047 ############################ 2023-10-17T18:23:42,047 Python recognizes 'moleculekit.bondguesser_utils' as an importable package[^1], 2023-10-17T18:23:42,047 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,047 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,047 package, please make sure that 'moleculekit.bondguesser_utils' is explicitly added 2023-10-17T18:23:42,047 to the `packages` configuration field. 2023-10-17T18:23:42,048 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,048 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,048 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,048 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,048 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,049 If you don't want 'moleculekit.bondguesser_utils' to be distributed and are 2023-10-17T18:23:42,049 already explicitly excluding 'moleculekit.bondguesser_utils' via 2023-10-17T18:23:42,049 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,049 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,049 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,049 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,049 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,050 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,050 even if it does not contain any `.py` files. 2023-10-17T18:23:42,050 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,050 directory, all directories are treated like packages. 2023-10-17T18:23:42,050 ******************************************************************************** 2023-10-17T18:23:42,051 !! 2023-10-17T18:23:42,051 check.warn(importable) 2023-10-17T18:23:42,051 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.distance_utils' is absent from the `packages` configuration. 2023-10-17T18:23:42,051 !! 2023-10-17T18:23:42,051 ******************************************************************************** 2023-10-17T18:23:42,051 ############################ 2023-10-17T18:23:42,051 # Package would be ignored # 2023-10-17T18:23:42,051 ############################ 2023-10-17T18:23:42,052 Python recognizes 'moleculekit.distance_utils' as an importable package[^1], 2023-10-17T18:23:42,052 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,052 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,052 package, please make sure that 'moleculekit.distance_utils' is explicitly added 2023-10-17T18:23:42,052 to the `packages` configuration field. 2023-10-17T18:23:42,052 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,053 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,053 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,053 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,053 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,053 If you don't want 'moleculekit.distance_utils' to be distributed and are 2023-10-17T18:23:42,053 already explicitly excluding 'moleculekit.distance_utils' via 2023-10-17T18:23:42,054 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,054 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,054 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,054 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,054 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,055 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,055 even if it does not contain any `.py` files. 2023-10-17T18:23:42,055 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,055 directory, all directories are treated like packages. 2023-10-17T18:23:42,055 ******************************************************************************** 2023-10-17T18:23:42,055 !! 2023-10-17T18:23:42,055 check.warn(importable) 2023-10-17T18:23:42,055 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.interactions.cationpi' is absent from the `packages` configuration. 2023-10-17T18:23:42,056 !! 2023-10-17T18:23:42,056 ******************************************************************************** 2023-10-17T18:23:42,056 ############################ 2023-10-17T18:23:42,056 # Package would be ignored # 2023-10-17T18:23:42,056 ############################ 2023-10-17T18:23:42,056 Python recognizes 'moleculekit.interactions.cationpi' as an importable package[^1], 2023-10-17T18:23:42,056 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,057 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,057 package, please make sure that 'moleculekit.interactions.cationpi' is explicitly added 2023-10-17T18:23:42,057 to the `packages` configuration field. 2023-10-17T18:23:42,057 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,057 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,057 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,057 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,058 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,058 If you don't want 'moleculekit.interactions.cationpi' to be distributed and are 2023-10-17T18:23:42,058 already explicitly excluding 'moleculekit.interactions.cationpi' via 2023-10-17T18:23:42,058 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,058 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,058 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,059 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,059 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,059 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,059 even if it does not contain any `.py` files. 2023-10-17T18:23:42,059 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,059 directory, all directories are treated like packages. 2023-10-17T18:23:42,060 ******************************************************************************** 2023-10-17T18:23:42,060 !! 2023-10-17T18:23:42,060 check.warn(importable) 2023-10-17T18:23:42,060 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.interactions.hbonds' is absent from the `packages` configuration. 2023-10-17T18:23:42,060 !! 2023-10-17T18:23:42,060 ******************************************************************************** 2023-10-17T18:23:42,060 ############################ 2023-10-17T18:23:42,061 # Package would be ignored # 2023-10-17T18:23:42,061 ############################ 2023-10-17T18:23:42,061 Python recognizes 'moleculekit.interactions.hbonds' as an importable package[^1], 2023-10-17T18:23:42,061 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,061 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,061 package, please make sure that 'moleculekit.interactions.hbonds' is explicitly added 2023-10-17T18:23:42,061 to the `packages` configuration field. 2023-10-17T18:23:42,062 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,062 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,062 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,062 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,062 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,062 If you don't want 'moleculekit.interactions.hbonds' to be distributed and are 2023-10-17T18:23:42,063 already explicitly excluding 'moleculekit.interactions.hbonds' via 2023-10-17T18:23:42,063 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,063 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,063 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,063 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,063 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,064 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,064 even if it does not contain any `.py` files. 2023-10-17T18:23:42,064 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,064 directory, all directories are treated like packages. 2023-10-17T18:23:42,064 ******************************************************************************** 2023-10-17T18:23:42,064 !! 2023-10-17T18:23:42,065 check.warn(importable) 2023-10-17T18:23:42,065 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.interactions.pipi' is absent from the `packages` configuration. 2023-10-17T18:23:42,065 !! 2023-10-17T18:23:42,065 ******************************************************************************** 2023-10-17T18:23:42,065 ############################ 2023-10-17T18:23:42,065 # Package would be ignored # 2023-10-17T18:23:42,065 ############################ 2023-10-17T18:23:42,065 Python recognizes 'moleculekit.interactions.pipi' as an importable package[^1], 2023-10-17T18:23:42,066 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,066 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,066 package, please make sure that 'moleculekit.interactions.pipi' is explicitly added 2023-10-17T18:23:42,066 to the `packages` configuration field. 2023-10-17T18:23:42,066 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,066 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,066 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,067 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,067 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,067 If you don't want 'moleculekit.interactions.pipi' to be distributed and are 2023-10-17T18:23:42,067 already explicitly excluding 'moleculekit.interactions.pipi' via 2023-10-17T18:23:42,067 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,067 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,068 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,068 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,068 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,068 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,068 even if it does not contain any `.py` files. 2023-10-17T18:23:42,069 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,069 directory, all directories are treated like packages. 2023-10-17T18:23:42,069 ******************************************************************************** 2023-10-17T18:23:42,069 !! 2023-10-17T18:23:42,069 check.warn(importable) 2023-10-17T18:23:42,069 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.interactions.sigmahole' is absent from the `packages` configuration. 2023-10-17T18:23:42,069 !! 2023-10-17T18:23:42,070 ******************************************************************************** 2023-10-17T18:23:42,070 ############################ 2023-10-17T18:23:42,070 # Package would be ignored # 2023-10-17T18:23:42,070 ############################ 2023-10-17T18:23:42,070 Python recognizes 'moleculekit.interactions.sigmahole' as an importable package[^1], 2023-10-17T18:23:42,070 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,070 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,070 package, please make sure that 'moleculekit.interactions.sigmahole' is explicitly added 2023-10-17T18:23:42,071 to the `packages` configuration field. 2023-10-17T18:23:42,071 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,071 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,071 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,071 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,071 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,072 If you don't want 'moleculekit.interactions.sigmahole' to be distributed and are 2023-10-17T18:23:42,072 already explicitly excluding 'moleculekit.interactions.sigmahole' via 2023-10-17T18:23:42,072 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,072 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,072 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,072 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,072 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,073 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,073 even if it does not contain any `.py` files. 2023-10-17T18:23:42,073 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,073 directory, all directories are treated like packages. 2023-10-17T18:23:42,073 ******************************************************************************** 2023-10-17T18:23:42,073 !! 2023-10-17T18:23:42,074 check.warn(importable) 2023-10-17T18:23:42,074 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.occupancy_utils' is absent from the `packages` configuration. 2023-10-17T18:23:42,074 !! 2023-10-17T18:23:42,074 ******************************************************************************** 2023-10-17T18:23:42,074 ############################ 2023-10-17T18:23:42,074 # Package would be ignored # 2023-10-17T18:23:42,074 ############################ 2023-10-17T18:23:42,074 Python recognizes 'moleculekit.occupancy_utils' as an importable package[^1], 2023-10-17T18:23:42,075 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,075 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,075 package, please make sure that 'moleculekit.occupancy_utils' is explicitly added 2023-10-17T18:23:42,075 to the `packages` configuration field. 2023-10-17T18:23:42,075 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,075 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,075 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,076 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,076 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,076 If you don't want 'moleculekit.occupancy_utils' to be distributed and are 2023-10-17T18:23:42,076 already explicitly excluding 'moleculekit.occupancy_utils' via 2023-10-17T18:23:42,076 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,076 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,076 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,077 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,077 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,077 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,077 even if it does not contain any `.py` files. 2023-10-17T18:23:42,077 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,077 directory, all directories are treated like packages. 2023-10-17T18:23:42,078 ******************************************************************************** 2023-10-17T18:23:42,078 !! 2023-10-17T18:23:42,078 check.warn(importable) 2023-10-17T18:23:42,078 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.share' is absent from the `packages` configuration. 2023-10-17T18:23:42,078 !! 2023-10-17T18:23:42,078 ******************************************************************************** 2023-10-17T18:23:42,078 ############################ 2023-10-17T18:23:42,079 # Package would be ignored # 2023-10-17T18:23:42,079 ############################ 2023-10-17T18:23:42,079 Python recognizes 'moleculekit.share' as an importable package[^1], 2023-10-17T18:23:42,079 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,079 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,079 package, please make sure that 'moleculekit.share' is explicitly added 2023-10-17T18:23:42,079 to the `packages` configuration field. 2023-10-17T18:23:42,080 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,080 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,080 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,080 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,080 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,080 If you don't want 'moleculekit.share' to be distributed and are 2023-10-17T18:23:42,081 already explicitly excluding 'moleculekit.share' via 2023-10-17T18:23:42,081 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,081 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,081 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,081 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,081 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,082 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,082 even if it does not contain any `.py` files. 2023-10-17T18:23:42,082 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,082 directory, all directories are treated like packages. 2023-10-17T18:23:42,082 ******************************************************************************** 2023-10-17T18:23:42,082 !! 2023-10-17T18:23:42,083 check.warn(importable) 2023-10-17T18:23:42,083 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.share.atomselect' is absent from the `packages` configuration. 2023-10-17T18:23:42,083 !! 2023-10-17T18:23:42,083 ******************************************************************************** 2023-10-17T18:23:42,083 ############################ 2023-10-17T18:23:42,083 # Package would be ignored # 2023-10-17T18:23:42,083 ############################ 2023-10-17T18:23:42,084 Python recognizes 'moleculekit.share.atomselect' as an importable package[^1], 2023-10-17T18:23:42,084 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,084 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,084 package, please make sure that 'moleculekit.share.atomselect' is explicitly added 2023-10-17T18:23:42,084 to the `packages` configuration field. 2023-10-17T18:23:42,084 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,085 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,085 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,085 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,085 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,085 If you don't want 'moleculekit.share.atomselect' to be distributed and are 2023-10-17T18:23:42,086 already explicitly excluding 'moleculekit.share.atomselect' via 2023-10-17T18:23:42,086 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,086 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,086 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,086 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,086 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,087 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,087 even if it does not contain any `.py` files. 2023-10-17T18:23:42,087 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,087 directory, all directories are treated like packages. 2023-10-17T18:23:42,087 ******************************************************************************** 2023-10-17T18:23:42,088 !! 2023-10-17T18:23:42,088 check.warn(importable) 2023-10-17T18:23:42,088 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.share.pdb2pqr.residues' is absent from the `packages` configuration. 2023-10-17T18:23:42,088 !! 2023-10-17T18:23:42,088 ******************************************************************************** 2023-10-17T18:23:42,088 ############################ 2023-10-17T18:23:42,088 # Package would be ignored # 2023-10-17T18:23:42,089 ############################ 2023-10-17T18:23:42,089 Python recognizes 'moleculekit.share.pdb2pqr.residues' as an importable package[^1], 2023-10-17T18:23:42,089 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,089 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,089 package, please make sure that 'moleculekit.share.pdb2pqr.residues' is explicitly added 2023-10-17T18:23:42,089 to the `packages` configuration field. 2023-10-17T18:23:42,090 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,090 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,090 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,090 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,090 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,090 If you don't want 'moleculekit.share.pdb2pqr.residues' to be distributed and are 2023-10-17T18:23:42,091 already explicitly excluding 'moleculekit.share.pdb2pqr.residues' via 2023-10-17T18:23:42,091 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,091 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,091 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,091 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,091 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,092 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,092 even if it does not contain any `.py` files. 2023-10-17T18:23:42,092 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,092 directory, all directories are treated like packages. 2023-10-17T18:23:42,092 ******************************************************************************** 2023-10-17T18:23:42,092 !! 2023-10-17T18:23:42,093 check.warn(importable) 2023-10-17T18:23:42,093 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.tmalign' is absent from the `packages` configuration. 2023-10-17T18:23:42,093 !! 2023-10-17T18:23:42,093 ******************************************************************************** 2023-10-17T18:23:42,093 ############################ 2023-10-17T18:23:42,093 # Package would be ignored # 2023-10-17T18:23:42,093 ############################ 2023-10-17T18:23:42,093 Python recognizes 'moleculekit.tmalign' as an importable package[^1], 2023-10-17T18:23:42,094 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,094 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,094 package, please make sure that 'moleculekit.tmalign' is explicitly added 2023-10-17T18:23:42,094 to the `packages` configuration field. 2023-10-17T18:23:42,094 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,095 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,095 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,096 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,096 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,097 If you don't want 'moleculekit.tmalign' to be distributed and are 2023-10-17T18:23:42,097 already explicitly excluding 'moleculekit.tmalign' via 2023-10-17T18:23:42,097 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,097 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,097 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,097 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,098 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,098 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,098 even if it does not contain any `.py` files. 2023-10-17T18:23:42,098 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,098 directory, all directories are treated like packages. 2023-10-17T18:23:42,098 ******************************************************************************** 2023-10-17T18:23:42,099 !! 2023-10-17T18:23:42,099 check.warn(importable) 2023-10-17T18:23:42,099 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.tmalign.include' is absent from the `packages` configuration. 2023-10-17T18:23:42,099 !! 2023-10-17T18:23:42,099 ******************************************************************************** 2023-10-17T18:23:42,099 ############################ 2023-10-17T18:23:42,099 # Package would be ignored # 2023-10-17T18:23:42,100 ############################ 2023-10-17T18:23:42,100 Python recognizes 'moleculekit.tmalign.include' as an importable package[^1], 2023-10-17T18:23:42,100 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,100 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,100 package, please make sure that 'moleculekit.tmalign.include' is explicitly added 2023-10-17T18:23:42,100 to the `packages` configuration field. 2023-10-17T18:23:42,101 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,101 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,101 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,101 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,101 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,102 If you don't want 'moleculekit.tmalign.include' to be distributed and are 2023-10-17T18:23:42,102 already explicitly excluding 'moleculekit.tmalign.include' via 2023-10-17T18:23:42,102 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,102 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,102 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,103 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,103 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,103 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,103 even if it does not contain any `.py` files. 2023-10-17T18:23:42,103 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,104 directory, all directories are treated like packages. 2023-10-17T18:23:42,104 ******************************************************************************** 2023-10-17T18:23:42,104 !! 2023-10-17T18:23:42,104 check.warn(importable) 2023-10-17T18:23:42,104 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.tmalign.src' is absent from the `packages` configuration. 2023-10-17T18:23:42,104 !! 2023-10-17T18:23:42,105 ******************************************************************************** 2023-10-17T18:23:42,105 ############################ 2023-10-17T18:23:42,105 # Package would be ignored # 2023-10-17T18:23:42,105 ############################ 2023-10-17T18:23:42,105 Python recognizes 'moleculekit.tmalign.src' as an importable package[^1], 2023-10-17T18:23:42,105 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,105 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,106 package, please make sure that 'moleculekit.tmalign.src' is explicitly added 2023-10-17T18:23:42,106 to the `packages` configuration field. 2023-10-17T18:23:42,106 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,106 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,106 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,106 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,107 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,107 If you don't want 'moleculekit.tmalign.src' to be distributed and are 2023-10-17T18:23:42,107 already explicitly excluding 'moleculekit.tmalign.src' via 2023-10-17T18:23:42,107 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,107 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,107 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,108 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,108 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,108 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,108 even if it does not contain any `.py` files. 2023-10-17T18:23:42,108 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,109 directory, all directories are treated like packages. 2023-10-17T18:23:42,109 ******************************************************************************** 2023-10-17T18:23:42,109 !! 2023-10-17T18:23:42,109 check.warn(importable) 2023-10-17T18:23:42,109 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.wrapping' is absent from the `packages` configuration. 2023-10-17T18:23:42,109 !! 2023-10-17T18:23:42,110 ******************************************************************************** 2023-10-17T18:23:42,110 ############################ 2023-10-17T18:23:42,110 # Package would be ignored # 2023-10-17T18:23:42,110 ############################ 2023-10-17T18:23:42,110 Python recognizes 'moleculekit.wrapping' as an importable package[^1], 2023-10-17T18:23:42,110 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,110 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,111 package, please make sure that 'moleculekit.wrapping' is explicitly added 2023-10-17T18:23:42,111 to the `packages` configuration field. 2023-10-17T18:23:42,111 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,111 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,111 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,111 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,112 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,112 If you don't want 'moleculekit.wrapping' to be distributed and are 2023-10-17T18:23:42,112 already explicitly excluding 'moleculekit.wrapping' via 2023-10-17T18:23:42,112 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,112 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,112 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,113 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,113 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,113 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,113 even if it does not contain any `.py` files. 2023-10-17T18:23:42,113 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,114 directory, all directories are treated like packages. 2023-10-17T18:23:42,114 ******************************************************************************** 2023-10-17T18:23:42,114 !! 2023-10-17T18:23:42,114 check.warn(importable) 2023-10-17T18:23:42,114 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.xtc_utils' is absent from the `packages` configuration. 2023-10-17T18:23:42,114 !! 2023-10-17T18:23:42,114 ******************************************************************************** 2023-10-17T18:23:42,115 ############################ 2023-10-17T18:23:42,115 # Package would be ignored # 2023-10-17T18:23:42,115 ############################ 2023-10-17T18:23:42,115 Python recognizes 'moleculekit.xtc_utils' as an importable package[^1], 2023-10-17T18:23:42,115 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,115 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,115 package, please make sure that 'moleculekit.xtc_utils' is explicitly added 2023-10-17T18:23:42,116 to the `packages` configuration field. 2023-10-17T18:23:42,116 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,116 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,116 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,116 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,117 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,117 If you don't want 'moleculekit.xtc_utils' to be distributed and are 2023-10-17T18:23:42,117 already explicitly excluding 'moleculekit.xtc_utils' via 2023-10-17T18:23:42,117 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,117 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,117 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,117 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,118 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,118 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,118 even if it does not contain any `.py` files. 2023-10-17T18:23:42,118 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,118 directory, all directories are treated like packages. 2023-10-17T18:23:42,118 ******************************************************************************** 2023-10-17T18:23:42,119 !! 2023-10-17T18:23:42,119 check.warn(importable) 2023-10-17T18:23:42,119 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.xtc_utils.include' is absent from the `packages` configuration. 2023-10-17T18:23:42,119 !! 2023-10-17T18:23:42,119 ******************************************************************************** 2023-10-17T18:23:42,119 ############################ 2023-10-17T18:23:42,120 # Package would be ignored # 2023-10-17T18:23:42,120 ############################ 2023-10-17T18:23:42,120 Python recognizes 'moleculekit.xtc_utils.include' as an importable package[^1], 2023-10-17T18:23:42,120 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,120 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,120 package, please make sure that 'moleculekit.xtc_utils.include' is explicitly added 2023-10-17T18:23:42,120 to the `packages` configuration field. 2023-10-17T18:23:42,121 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,121 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,121 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,122 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,123 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,125 If you don't want 'moleculekit.xtc_utils.include' to be distributed and are 2023-10-17T18:23:42,125 already explicitly excluding 'moleculekit.xtc_utils.include' via 2023-10-17T18:23:42,125 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,125 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,125 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,125 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,126 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,126 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,126 even if it does not contain any `.py` files. 2023-10-17T18:23:42,126 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,126 directory, all directories are treated like packages. 2023-10-17T18:23:42,126 ******************************************************************************** 2023-10-17T18:23:42,127 !! 2023-10-17T18:23:42,127 check.warn(importable) 2023-10-17T18:23:42,127 /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:204: _Warning: Package 'moleculekit.xtc_utils.src' is absent from the `packages` configuration. 2023-10-17T18:23:42,127 !! 2023-10-17T18:23:42,127 ******************************************************************************** 2023-10-17T18:23:42,127 ############################ 2023-10-17T18:23:42,128 # Package would be ignored # 2023-10-17T18:23:42,128 ############################ 2023-10-17T18:23:42,128 Python recognizes 'moleculekit.xtc_utils.src' as an importable package[^1], 2023-10-17T18:23:42,128 but it is absent from setuptools' `packages` configuration. 2023-10-17T18:23:42,128 This leads to an ambiguous overall configuration. If you want to distribute this 2023-10-17T18:23:42,128 package, please make sure that 'moleculekit.xtc_utils.src' is explicitly added 2023-10-17T18:23:42,129 to the `packages` configuration field. 2023-10-17T18:23:42,129 Alternatively, you can also rely on setuptools' discovery methods 2023-10-17T18:23:42,129 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2023-10-17T18:23:42,129 instead of `find_packages(...)`/`find:`). 2023-10-17T18:23:42,129 You can read more about "package discovery" on setuptools documentation page: 2023-10-17T18:23:42,130 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2023-10-17T18:23:42,130 If you don't want 'moleculekit.xtc_utils.src' to be distributed and are 2023-10-17T18:23:42,130 already explicitly excluding 'moleculekit.xtc_utils.src' via 2023-10-17T18:23:42,130 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2023-10-17T18:23:42,130 you can try to use `exclude_package_data`, or `include-package-data=False` in 2023-10-17T18:23:42,130 combination with a more fine grained `package-data` configuration. 2023-10-17T18:23:42,131 You can read more about "package data files" on setuptools documentation page: 2023-10-17T18:23:42,131 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2023-10-17T18:23:42,131 [^1]: For Python, any directory (with suitable naming) can be imported, 2023-10-17T18:23:42,131 even if it does not contain any `.py` files. 2023-10-17T18:23:42,131 On the other hand, currently there is no concept of package data 2023-10-17T18:23:42,132 directory, all directories are treated like packages. 2023-10-17T18:23:42,132 ******************************************************************************** 2023-10-17T18:23:42,132 !! 2023-10-17T18:23:42,132 check.warn(importable) 2023-10-17T18:23:42,132 copying moleculekit/logging.ini -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:42,132 copying moleculekit/vmd_wrapper -> build/lib.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:42,132 creating build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2023-10-17T18:23:42,132 copying moleculekit/atomselect_utils/atomselect_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2023-10-17T18:23:42,133 copying moleculekit/atomselect_utils/atomselect_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2023-10-17T18:23:42,133 creating build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2023-10-17T18:23:42,133 copying moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2023-10-17T18:23:42,155 copying moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2023-10-17T18:23:42,157 creating build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2023-10-17T18:23:42,158 copying moleculekit/distance_utils/distance_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2023-10-17T18:23:42,182 copying moleculekit/distance_utils/distance_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2023-10-17T18:23:42,185 creating build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2023-10-17T18:23:42,186 copying moleculekit/occupancy_utils/occupancy_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2023-10-17T18:23:42,203 copying moleculekit/occupancy_utils/occupancy_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2023-10-17T18:23:42,205 creating build/lib.linux-armv7l-cpython-39/moleculekit/share 2023-10-17T18:23:42,206 copying moleculekit/share/ALA.cif -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2023-10-17T18:23:42,209 copying moleculekit/share/backbone.cif -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2023-10-17T18:23:42,211 copying moleculekit/share/opm_sequences.json -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2023-10-17T18:23:42,419 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect 2023-10-17T18:23:42,419 copying moleculekit/share/atomselect/atomselect.json -> build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect 2023-10-17T18:23:42,422 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr 2023-10-17T18:23:42,422 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,423 copying moleculekit/share/pdb2pqr/residues/.gitkeep -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,425 copying moleculekit/share/pdb2pqr/residues/004.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,427 copying moleculekit/share/pdb2pqr/residues/004.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,429 copying moleculekit/share/pdb2pqr/residues/03Y.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,431 copying moleculekit/share/pdb2pqr/residues/03Y.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,433 copying moleculekit/share/pdb2pqr/residues/0A1.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,435 copying moleculekit/share/pdb2pqr/residues/0A1.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,438 copying moleculekit/share/pdb2pqr/residues/0AF.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,439 copying moleculekit/share/pdb2pqr/residues/0AF.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,442 copying moleculekit/share/pdb2pqr/residues/0BN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,444 copying moleculekit/share/pdb2pqr/residues/0BN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,446 copying moleculekit/share/pdb2pqr/residues/1MH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,448 copying moleculekit/share/pdb2pqr/residues/1MH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,450 copying moleculekit/share/pdb2pqr/residues/2AS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,452 copying moleculekit/share/pdb2pqr/residues/2AS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,454 copying moleculekit/share/pdb2pqr/residues/2GX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,455 copying moleculekit/share/pdb2pqr/residues/2GX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,458 copying moleculekit/share/pdb2pqr/residues/2ML.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,459 copying moleculekit/share/pdb2pqr/residues/2ML.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,461 copying moleculekit/share/pdb2pqr/residues/2MR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,463 copying moleculekit/share/pdb2pqr/residues/2MR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,466 copying moleculekit/share/pdb2pqr/residues/4IN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,467 copying moleculekit/share/pdb2pqr/residues/4IN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,469 copying moleculekit/share/pdb2pqr/residues/4PH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,471 copying moleculekit/share/pdb2pqr/residues/4PH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,473 copying moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,475 copying moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,477 copying moleculekit/share/pdb2pqr/residues/5JP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,479 copying moleculekit/share/pdb2pqr/residues/5JP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,481 copying moleculekit/share/pdb2pqr/residues/AA4.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,483 copying moleculekit/share/pdb2pqr/residues/AA4.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,485 copying moleculekit/share/pdb2pqr/residues/ABA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,487 copying moleculekit/share/pdb2pqr/residues/ABA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,489 copying moleculekit/share/pdb2pqr/residues/AHP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,491 copying moleculekit/share/pdb2pqr/residues/AHP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,493 copying moleculekit/share/pdb2pqr/residues/ALC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,495 copying moleculekit/share/pdb2pqr/residues/ALC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,497 copying moleculekit/share/pdb2pqr/residues/ALN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,499 copying moleculekit/share/pdb2pqr/residues/ALN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,501 copying moleculekit/share/pdb2pqr/residues/ALY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,503 copying moleculekit/share/pdb2pqr/residues/ALY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,505 copying moleculekit/share/pdb2pqr/residues/APD.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,507 copying moleculekit/share/pdb2pqr/residues/APD.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,509 copying moleculekit/share/pdb2pqr/residues/BB8.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,511 copying moleculekit/share/pdb2pqr/residues/BB8.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,513 copying moleculekit/share/pdb2pqr/residues/BCS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,515 copying moleculekit/share/pdb2pqr/residues/BCS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,517 copying moleculekit/share/pdb2pqr/residues/BTK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,519 copying moleculekit/share/pdb2pqr/residues/BTK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,522 copying moleculekit/share/pdb2pqr/residues/CCS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,524 copying moleculekit/share/pdb2pqr/residues/CCS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,526 copying moleculekit/share/pdb2pqr/residues/CGU.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,528 copying moleculekit/share/pdb2pqr/residues/CGU.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,530 copying moleculekit/share/pdb2pqr/residues/CSA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,532 copying moleculekit/share/pdb2pqr/residues/CSA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,534 copying moleculekit/share/pdb2pqr/residues/CSO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,535 copying moleculekit/share/pdb2pqr/residues/CSO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,538 copying moleculekit/share/pdb2pqr/residues/CSP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,539 copying moleculekit/share/pdb2pqr/residues/CSP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,541 copying moleculekit/share/pdb2pqr/residues/CSS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,543 copying moleculekit/share/pdb2pqr/residues/CSS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,545 copying moleculekit/share/pdb2pqr/residues/D4P.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,547 copying moleculekit/share/pdb2pqr/residues/D4P.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,549 copying moleculekit/share/pdb2pqr/residues/DA2.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,551 copying moleculekit/share/pdb2pqr/residues/DA2.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,554 copying moleculekit/share/pdb2pqr/residues/DAB.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,556 copying moleculekit/share/pdb2pqr/residues/DAB.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,558 copying moleculekit/share/pdb2pqr/residues/DAH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,560 copying moleculekit/share/pdb2pqr/residues/DAH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,562 copying moleculekit/share/pdb2pqr/residues/DPP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,564 copying moleculekit/share/pdb2pqr/residues/DPP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,566 copying moleculekit/share/pdb2pqr/residues/ESC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,568 copying moleculekit/share/pdb2pqr/residues/ESC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,570 copying moleculekit/share/pdb2pqr/residues/FGL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,572 copying moleculekit/share/pdb2pqr/residues/FGL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,574 copying moleculekit/share/pdb2pqr/residues/GHG.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,576 copying moleculekit/share/pdb2pqr/residues/GHG.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,578 copying moleculekit/share/pdb2pqr/residues/GME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,580 copying moleculekit/share/pdb2pqr/residues/GME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,582 copying moleculekit/share/pdb2pqr/residues/GNC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,584 copying moleculekit/share/pdb2pqr/residues/GNC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,586 copying moleculekit/share/pdb2pqr/residues/HHK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,588 copying moleculekit/share/pdb2pqr/residues/HHK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,590 copying moleculekit/share/pdb2pqr/residues/HLU.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,592 copying moleculekit/share/pdb2pqr/residues/HLU.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,594 copying moleculekit/share/pdb2pqr/residues/HLX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,596 copying moleculekit/share/pdb2pqr/residues/HLX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,598 copying moleculekit/share/pdb2pqr/residues/HOX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,599 copying moleculekit/share/pdb2pqr/residues/HOX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,601 copying moleculekit/share/pdb2pqr/residues/HPE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,603 copying moleculekit/share/pdb2pqr/residues/HPE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,605 copying moleculekit/share/pdb2pqr/residues/HQA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,607 copying moleculekit/share/pdb2pqr/residues/HQA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,609 copying moleculekit/share/pdb2pqr/residues/HTR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,611 copying moleculekit/share/pdb2pqr/residues/HTR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,614 copying moleculekit/share/pdb2pqr/residues/HYP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,616 copying moleculekit/share/pdb2pqr/residues/HYP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,618 copying moleculekit/share/pdb2pqr/residues/I2M.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,619 copying moleculekit/share/pdb2pqr/residues/I2M.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,622 copying moleculekit/share/pdb2pqr/residues/IGL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,624 copying moleculekit/share/pdb2pqr/residues/IGL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,626 copying moleculekit/share/pdb2pqr/residues/IIL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,628 copying moleculekit/share/pdb2pqr/residues/IIL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,630 copying moleculekit/share/pdb2pqr/residues/IML.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,632 copying moleculekit/share/pdb2pqr/residues/IML.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,634 copying moleculekit/share/pdb2pqr/residues/KYN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,636 copying moleculekit/share/pdb2pqr/residues/KYN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,639 copying moleculekit/share/pdb2pqr/residues/LME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,641 copying moleculekit/share/pdb2pqr/residues/LME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,643 copying moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,645 copying moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,647 copying moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,649 copying moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,652 copying moleculekit/share/pdb2pqr/residues/M3L.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,654 copying moleculekit/share/pdb2pqr/residues/M3L.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,656 copying moleculekit/share/pdb2pqr/residues/ME0.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,658 copying moleculekit/share/pdb2pqr/residues/ME0.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,660 copying moleculekit/share/pdb2pqr/residues/MEA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,662 copying moleculekit/share/pdb2pqr/residues/MEA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,664 copying moleculekit/share/pdb2pqr/residues/MEN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,666 copying moleculekit/share/pdb2pqr/residues/MEN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,669 copying moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,671 copying moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,673 copying moleculekit/share/pdb2pqr/residues/MLE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,675 copying moleculekit/share/pdb2pqr/residues/MLE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,677 copying moleculekit/share/pdb2pqr/residues/MLY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,679 copying moleculekit/share/pdb2pqr/residues/MLY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,681 copying moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,683 copying moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,686 copying moleculekit/share/pdb2pqr/residues/MME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,688 copying moleculekit/share/pdb2pqr/residues/MME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,690 copying moleculekit/share/pdb2pqr/residues/MMO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,692 copying moleculekit/share/pdb2pqr/residues/MMO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,694 copying moleculekit/share/pdb2pqr/residues/MVA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,696 copying moleculekit/share/pdb2pqr/residues/MVA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,698 copying moleculekit/share/pdb2pqr/residues/NAL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,700 copying moleculekit/share/pdb2pqr/residues/NAL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,703 copying moleculekit/share/pdb2pqr/residues/NCY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,704 copying moleculekit/share/pdb2pqr/residues/NCY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,706 copying moleculekit/share/pdb2pqr/residues/NLE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,708 copying moleculekit/share/pdb2pqr/residues/NLE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,711 copying moleculekit/share/pdb2pqr/residues/NVA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,713 copying moleculekit/share/pdb2pqr/residues/NVA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,715 copying moleculekit/share/pdb2pqr/residues/NZC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,717 copying moleculekit/share/pdb2pqr/residues/NZC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,719 copying moleculekit/share/pdb2pqr/residues/OCY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,721 copying moleculekit/share/pdb2pqr/residues/OCY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,723 copying moleculekit/share/pdb2pqr/residues/OMX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,725 copying moleculekit/share/pdb2pqr/residues/OMX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,727 copying moleculekit/share/pdb2pqr/residues/ONL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,729 copying moleculekit/share/pdb2pqr/residues/ONL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,731 copying moleculekit/share/pdb2pqr/residues/ORM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,733 copying moleculekit/share/pdb2pqr/residues/ORM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,735 copying moleculekit/share/pdb2pqr/residues/P1L.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,737 copying moleculekit/share/pdb2pqr/residues/P1L.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,740 copying moleculekit/share/pdb2pqr/residues/PCA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,742 copying moleculekit/share/pdb2pqr/residues/PCA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,744 copying moleculekit/share/pdb2pqr/residues/PRK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,746 copying moleculekit/share/pdb2pqr/residues/PRK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,748 copying moleculekit/share/pdb2pqr/residues/PTR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,750 copying moleculekit/share/pdb2pqr/residues/PTR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,753 copying moleculekit/share/pdb2pqr/residues/SEP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,754 copying moleculekit/share/pdb2pqr/residues/SEP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,756 copying moleculekit/share/pdb2pqr/residues/TPO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,758 copying moleculekit/share/pdb2pqr/residues/TPO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,760 copying moleculekit/share/pdb2pqr/residues/TRO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,763 copying moleculekit/share/pdb2pqr/residues/TRO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,765 copying moleculekit/share/pdb2pqr/residues/TY2.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,767 copying moleculekit/share/pdb2pqr/residues/TY2.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,769 copying moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,771 copying moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,773 copying moleculekit/share/pdb2pqr/residues/YCM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,775 copying moleculekit/share/pdb2pqr/residues/YCM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,777 copying moleculekit/share/pdb2pqr/residues/YNM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,779 copying moleculekit/share/pdb2pqr/residues/YNM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2023-10-17T18:23:42,781 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2023-10-17T18:23:42,782 copying moleculekit/tmalign/tmalign_util.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2023-10-17T18:23:42,802 copying moleculekit/tmalign/tmalign_util.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2023-10-17T18:23:42,804 copying moleculekit/tmalign/tmalignlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2023-10-17T18:23:42,806 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include 2023-10-17T18:23:42,806 copying moleculekit/tmalign/include/TMAlign.h -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include 2023-10-17T18:23:42,808 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src 2023-10-17T18:23:42,809 copying moleculekit/tmalign/src/TMAlign.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src 2023-10-17T18:23:42,815 creating build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2023-10-17T18:23:42,816 copying moleculekit/wrapping/wrapping.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2023-10-17T18:23:42,836 copying moleculekit/wrapping/wrapping.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2023-10-17T18:23:42,838 creating build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils 2023-10-17T18:23:42,839 copying moleculekit/xtc_utils/xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils 2023-10-17T18:23:42,857 copying moleculekit/xtc_utils/xtc.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils 2023-10-17T18:23:42,859 copying moleculekit/xtc_utils/xtclib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils 2023-10-17T18:23:42,861 creating build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/include 2023-10-17T18:23:42,862 copying moleculekit/xtc_utils/include/xdrfile.h -> build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/include 2023-10-17T18:23:42,865 copying moleculekit/xtc_utils/include/xdrfile_xtc.h -> build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/include 2023-10-17T18:23:42,867 copying moleculekit/xtc_utils/include/xtc.h -> build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/include 2023-10-17T18:23:42,868 creating build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/src 2023-10-17T18:23:42,869 copying moleculekit/xtc_utils/src/xdrfile.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/src 2023-10-17T18:23:42,873 copying moleculekit/xtc_utils/src/xdrfile_xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/src 2023-10-17T18:23:42,875 copying moleculekit/xtc_utils/src/xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/src 2023-10-17T18:23:42,877 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2023-10-17T18:23:42,878 copying moleculekit/interactions/cationpi/cationpi.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2023-10-17T18:23:42,898 copying moleculekit/interactions/cationpi/cationpi.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2023-10-17T18:23:42,900 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2023-10-17T18:23:42,901 copying moleculekit/interactions/hbonds/hbonds.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2023-10-17T18:23:42,925 copying moleculekit/interactions/hbonds/hbonds.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2023-10-17T18:23:42,928 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2023-10-17T18:23:42,928 copying moleculekit/interactions/pipi/pipi.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2023-10-17T18:23:42,948 copying moleculekit/interactions/pipi/pipi.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2023-10-17T18:23:42,950 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2023-10-17T18:23:42,951 copying moleculekit/interactions/sigmahole/sigmahole.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2023-10-17T18:23:42,975 copying moleculekit/interactions/sigmahole/sigmahole.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2023-10-17T18:23:42,986 UPDATING build/lib.linux-armv7l-cpython-39/moleculekit/_version.py 2023-10-17T18:23:42,987 set build/lib.linux-armv7l-cpython-39/moleculekit/_version.py to '1.8.3' 2023-10-17T18:23:42,987 running build_ext 2023-10-17T18:23:42,998 building 'moleculekit.interactions.hbonds' extension 2023-10-17T18:23:42,998 creating build/temp.linux-armv7l-cpython-39 2023-10-17T18:23:42,999 creating build/temp.linux-armv7l-cpython-39/moleculekit 2023-10-17T18:23:43,000 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions 2023-10-17T18:23:43,000 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2023-10-17T18:23:43,001 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-2lr9d234/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 2023-10-17T18:23:43,292 In file included from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-17T18:23:43,292 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-17T18:23:43,292 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-17T18:23:43,293 from moleculekit/interactions/hbonds/hbonds.cpp:1219: 2023-10-17T18:23:43,293 /tmp/pip-build-env-2lr9d234/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] 2023-10-17T18:23:43,293 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-17T18:23:43,293 | ^~~~~~~ 2023-10-17T18:24:09,732 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 2023-10-17T18:24:10,091 building 'moleculekit.interactions.pipi' extension 2023-10-17T18:24:10,092 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2023-10-17T18:24:10,094 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-2lr9d234/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 2023-10-17T18:24:10,363 In file included from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-17T18:24:10,363 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-17T18:24:10,363 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-17T18:24:10,364 from moleculekit/interactions/pipi/pipi.cpp:1219: 2023-10-17T18:24:10,364 /tmp/pip-build-env-2lr9d234/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] 2023-10-17T18:24:10,364 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-17T18:24:10,364 | ^~~~~~~ 2023-10-17T18:24:38,609 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 2023-10-17T18:24:38,927 building 'moleculekit.interactions.cationpi' extension 2023-10-17T18:24:38,928 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2023-10-17T18:24:38,928 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-2lr9d234/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 2023-10-17T18:24:39,166 In file included from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-17T18:24:39,166 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-17T18:24:39,166 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-17T18:24:39,167 from moleculekit/interactions/cationpi/cationpi.cpp:1219: 2023-10-17T18:24:39,167 /tmp/pip-build-env-2lr9d234/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] 2023-10-17T18:24:39,167 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-17T18:24:39,167 | ^~~~~~~ 2023-10-17T18:25:07,199 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 2023-10-17T18:25:07,519 building 'moleculekit.interactions.sigmahole' extension 2023-10-17T18:25:07,520 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2023-10-17T18:25:07,521 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-2lr9d234/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 2023-10-17T18:25:07,762 In file included from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-17T18:25:07,763 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-17T18:25:07,763 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-17T18:25:07,763 from moleculekit/interactions/sigmahole/sigmahole.cpp:1219: 2023-10-17T18:25:07,763 /tmp/pip-build-env-2lr9d234/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] 2023-10-17T18:25:07,763 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-17T18:25:07,763 | ^~~~~~~ 2023-10-17T18:25:35,112 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 2023-10-17T18:25:35,435 building 'moleculekit.wrapping' extension 2023-10-17T18:25:35,436 creating build/temp.linux-armv7l-cpython-39/moleculekit/wrapping 2023-10-17T18:25:35,436 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-2lr9d234/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 2023-10-17T18:25:35,675 In file included from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-17T18:25:35,675 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-17T18:25:35,675 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-17T18:25:35,675 from moleculekit/wrapping/wrapping.cpp:1219: 2023-10-17T18:25:35,676 /tmp/pip-build-env-2lr9d234/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] 2023-10-17T18:25:35,676 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-17T18:25:35,676 | ^~~~~~~ 2023-10-17T18:25:59,396 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 2023-10-17T18:25:59,606 building 'moleculekit.bondguesser_utils' extension 2023-10-17T18:25:59,607 creating build/temp.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2023-10-17T18:25:59,608 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-2lr9d234/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 2023-10-17T18:25:59,847 In file included from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-17T18:25:59,847 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-17T18:25:59,847 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-17T18:25:59,847 from moleculekit/bondguesser_utils/bondguesser_utils.cpp:1219: 2023-10-17T18:25:59,847 /tmp/pip-build-env-2lr9d234/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] 2023-10-17T18:25:59,847 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-17T18:25:59,848 | ^~~~~~~ 2023-10-17T18:26:01,389 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)’: 2023-10-17T18:26:01,389 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19759:33: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2023-10-17T18:26:01,389 19759 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2023-10-17T18:26:01,389 | ~~~~~~~~~~^~~~~~~~~~~ 2023-10-17T18:26:01,390 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19771:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2023-10-17T18:26:01,390 19771 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2023-10-17T18:26:01,390 | ~~~~~~~~~~^~~~~~~~~~~ 2023-10-17T18:26:01,390 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19783:37: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2023-10-17T18:26:01,390 19783 | for (__pyx_t_9 = 0; __pyx_t_9 < __pyx_t_8; __pyx_t_9+=1) { 2023-10-17T18:26:01,390 | ~~~~~~~~~~^~~~~~~~~~~ 2023-10-17T18:26:01,391 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19822:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,391 19822 | __pyx_t_12 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2023-10-17T18:26:01,391 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,391 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19861:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,391 19861 | __pyx_t_12 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2023-10-17T18:26:01,391 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,392 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19900:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,392 19900 | __pyx_t_12 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2023-10-17T18:26:01,392 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,392 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19939:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,392 19939 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2023-10-17T18:26:01,392 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,392 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19945:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,393 19945 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2023-10-17T18:26:01,393 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,393 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19986:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,393 19986 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2023-10-17T18:26:01,393 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,393 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19992:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,393 19992 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2023-10-17T18:26:01,393 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,394 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20033:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,394 20033 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2023-10-17T18:26:01,394 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,394 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20039:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,394 20039 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2023-10-17T18:26:01,394 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,394 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20080:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,395 20080 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2023-10-17T18:26:01,395 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,395 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20133:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,395 20133 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2023-10-17T18:26:01,395 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,395 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20180:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,396 20180 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2023-10-17T18:26:01,396 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,396 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20221:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,396 20221 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2023-10-17T18:26:01,396 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,396 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20227:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,396 20227 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2023-10-17T18:26:01,396 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,397 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20233:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,397 20233 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2023-10-17T18:26:01,397 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,397 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20280:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,397 20280 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2023-10-17T18:26:01,397 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,397 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20286:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,398 20286 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2023-10-17T18:26:01,398 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,398 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20327:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,398 20327 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2023-10-17T18:26:01,398 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,398 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20339:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,398 20339 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2023-10-17T18:26:01,399 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,399 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20392:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2023-10-17T18:26:01,399 20392 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2023-10-17T18:26:01,399 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,417 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)’: 2023-10-17T18:26:01,418 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21014:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2023-10-17T18:26:01,418 21014 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_n_boxes); 2023-10-17T18:26:01,418 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~ 2023-10-17T18:26:01,418 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21051:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2023-10-17T18:26:01,418 21051 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_boxidx); 2023-10-17T18:26:01,418 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2023-10-17T18:26:24,482 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 2023-10-17T18:26:24,781 building 'moleculekit.atomselect_utils' extension 2023-10-17T18:26:24,782 creating build/temp.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2023-10-17T18:26:24,782 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-2lr9d234/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 2023-10-17T18:26:25,024 In file included from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-17T18:26:25,024 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-17T18:26:25,024 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-17T18:26:25,024 from moleculekit/atomselect_utils/atomselect_utils.cpp:1236: 2023-10-17T18:26:25,025 /tmp/pip-build-env-2lr9d234/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] 2023-10-17T18:26:25,025 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-17T18:26:25,025 | ^~~~~~~ 2023-10-17T18:26:26,750 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 >&)’: 2023-10-17T18:26:26,750 moleculekit/atomselect_utils/atomselect_utils.cpp:23713:161: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2023-10-17T18:26:26,751 23713 | __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); 2023-10-17T18:26:26,751 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2023-10-17T18:26:26,756 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 >&)’: 2023-10-17T18:26:26,756 moleculekit/atomselect_utils/atomselect_utils.cpp:23965:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2023-10-17T18:26:26,756 23965 | __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); 2023-10-17T18:26:26,756 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2023-10-17T18:26:26,761 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 >&)’: 2023-10-17T18:26:26,762 moleculekit/atomselect_utils/atomselect_utils.cpp:24232:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2023-10-17T18:26:26,762 24232 | __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); 2023-10-17T18:26:26,762 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2023-10-17T18:26:57,323 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 2023-10-17T18:26:57,648 building 'moleculekit.distance_utils' extension 2023-10-17T18:26:57,648 creating build/temp.linux-armv7l-cpython-39/moleculekit/distance_utils 2023-10-17T18:26:57,649 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-2lr9d234/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 2023-10-17T18:26:57,887 In file included from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-17T18:26:57,888 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-17T18:26:57,888 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-17T18:26:57,888 from moleculekit/distance_utils/distance_utils.cpp:1219: 2023-10-17T18:26:57,888 /tmp/pip-build-env-2lr9d234/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] 2023-10-17T18:26:57,888 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-17T18:26:57,888 | ^~~~~~~ 2023-10-17T18:27:30,308 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 2023-10-17T18:27:30,630 building 'moleculekit.occupancy_utils' extension 2023-10-17T18:27:30,630 creating build/temp.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2023-10-17T18:27:30,631 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-2lr9d234/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 2023-10-17T18:27:30,874 In file included from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-17T18:27:30,875 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-17T18:27:30,875 from /tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-17T18:27:30,875 from moleculekit/occupancy_utils/occupancy_utils.cpp:1219: 2023-10-17T18:27:30,875 /tmp/pip-build-env-2lr9d234/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] 2023-10-17T18:27:30,875 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-17T18:27:30,875 | ^~~~~~~ 2023-10-17T18:27:53,912 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 2023-10-17T18:27:54,120 building 'moleculekit.xtc' extension 2023-10-17T18:27:54,121 creating build/temp.linux-armv7l-cpython-39/moleculekit/xtc_utils 2023-10-17T18:27:54,121 creating build/temp.linux-armv7l-cpython-39/moleculekit/xtc_utils/src 2023-10-17T18:27:54,123 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/xtc_utils -Imoleculekit/xtc_utils/include/ -Imoleculekit/xtc_utils/ -I/tmp/pip-build-env-2lr9d234/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/xtc_utils/src/xdrfile.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/xtc_utils/src/xdrfile.o 2023-10-17T18:27:54,361 moleculekit/xtc_utils/src/xdrfile.cpp:66:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,362 66 | "OK", 2023-10-17T18:27:54,362 | ^~~~ 2023-10-17T18:27:54,362 moleculekit/xtc_utils/src/xdrfile.cpp:67:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,362 67 | "Header", 2023-10-17T18:27:54,362 | ^~~~~~~~ 2023-10-17T18:27:54,363 moleculekit/xtc_utils/src/xdrfile.cpp:68:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,363 68 | "String", 2023-10-17T18:27:54,363 | ^~~~~~~~ 2023-10-17T18:27:54,363 moleculekit/xtc_utils/src/xdrfile.cpp:69:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,363 69 | "Double", 2023-10-17T18:27:54,364 | ^~~~~~~~ 2023-10-17T18:27:54,364 moleculekit/xtc_utils/src/xdrfile.cpp:70:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,364 70 | "Integer", 2023-10-17T18:27:54,364 | ^~~~~~~~~ 2023-10-17T18:27:54,364 moleculekit/xtc_utils/src/xdrfile.cpp:71:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,364 71 | "Float", 2023-10-17T18:27:54,365 | ^~~~~~~ 2023-10-17T18:27:54,365 moleculekit/xtc_utils/src/xdrfile.cpp:72:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,365 72 | "Unsigned integer", 2023-10-17T18:27:54,365 | ^~~~~~~~~~~~~~~~~~ 2023-10-17T18:27:54,365 moleculekit/xtc_utils/src/xdrfile.cpp:73:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,365 73 | "Compressed 3D coordinate", 2023-10-17T18:27:54,366 | ^~~~~~~~~~~~~~~~~~~~~~~~~~ 2023-10-17T18:27:54,366 moleculekit/xtc_utils/src/xdrfile.cpp:74:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,366 74 | "Closing file", 2023-10-17T18:27:54,366 | ^~~~~~~~~~~~~~ 2023-10-17T18:27:54,366 moleculekit/xtc_utils/src/xdrfile.cpp:75:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,366 75 | "Magic number", 2023-10-17T18:27:54,366 | ^~~~~~~~~~~~~~ 2023-10-17T18:27:54,367 moleculekit/xtc_utils/src/xdrfile.cpp:76:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,367 76 | "Not enough memory", 2023-10-17T18:27:54,367 | ^~~~~~~~~~~~~~~~~~~ 2023-10-17T18:27:54,367 moleculekit/xtc_utils/src/xdrfile.cpp:77:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,367 77 | "End of file", 2023-10-17T18:27:54,367 | ^~~~~~~~~~~~~ 2023-10-17T18:27:54,368 moleculekit/xtc_utils/src/xdrfile.cpp:78:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2023-10-17T18:27:54,368 78 | "File not found" 2023-10-17T18:27:54,368 | ^~~~~~~~~~~~~~~~ 2023-10-17T18:27:54,376 moleculekit/xtc_utils/src/xdrfile.cpp: In function ‘int sizeofint(int)’: 2023-10-17T18:27:54,376 moleculekit/xtc_utils/src/xdrfile.cpp:459:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,376 459 | while (size >= num && num_of_bits < 32) 2023-10-17T18:27:54,376 | ~~~~~^~~~~~ 2023-10-17T18:27:54,378 moleculekit/xtc_utils/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2023-10-17T18:27:54,378 moleculekit/xtc_utils/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2023-10-17T18:27:54,378 505 | while (bytes[num_of_bytes] >= num) 2023-10-17T18:27:54,378 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2023-10-17T18:27:54,381 moleculekit/xtc_utils/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2023-10-17T18:27:54,381 moleculekit/xtc_utils/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,381 614 | if (num_of_bits >= num_of_bytes * 8) 2023-10-17T18:27:54,381 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2023-10-17T18:27:54,381 moleculekit/xtc_utils/src/xdrfile.cpp:616:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,382 616 | for (i = 0; i < num_of_bytes; i++) 2023-10-17T18:27:54,382 | ~~^~~~~~~~~~~~~~ 2023-10-17T18:27:54,382 moleculekit/xtc_utils/src/xdrfile.cpp:624:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,382 624 | for (i = 0; i < num_of_bytes-1; i++) 2023-10-17T18:27:54,383 | ~~^~~~~~~~~~~~~~~~ 2023-10-17T18:27:54,384 moleculekit/xtc_utils/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2023-10-17T18:27:54,384 moleculekit/xtc_utils/src/xdrfile.cpp:664:16: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2023-10-17T18:27:54,384 664 | if (lastbits < num_of_bits) 2023-10-17T18:27:54,384 | ~~~~~~~~~^~~~~~~~~~~~~ 2023-10-17T18:27:54,388 moleculekit/xtc_utils/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2023-10-17T18:27:54,388 moleculekit/xtc_utils/src/xdrfile.cpp:785:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2023-10-17T18:27:54,389 785 | if(size3>xfp->buf1size) 2023-10-17T18:27:54,389 | ~~~~~^~~~~~~~~~~~~~ 2023-10-17T18:27:54,391 moleculekit/xtc_utils/src/xdrfile.cpp:842:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2023-10-17T18:27:54,391 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2023-10-17T18:27:54,394 | ~~~~~~~~~^~~~~~~~ 2023-10-17T18:27:54,395 moleculekit/xtc_utils/src/xdrfile.cpp:935:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,395 935 | if(countmjh >= size3 ) { return -1; } 2023-10-17T18:27:54,395 | ~~~~~~~~~^~~~~~~~ 2023-10-17T18:27:54,396 moleculekit/xtc_utils/src/xdrfile.cpp:938:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,396 938 | if(countmjh >= size3 ) { return -1; } 2023-10-17T18:27:54,396 | ~~~~~~~~~^~~~~~~~ 2023-10-17T18:27:54,396 moleculekit/xtc_utils/src/xdrfile.cpp:945:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,397 945 | if(countmjh >= size3 ) { return -1; } 2023-10-17T18:27:54,397 | ~~~~~~~~~^~~~~~~~ 2023-10-17T18:27:54,397 moleculekit/xtc_utils/src/xdrfile.cpp:948:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,397 948 | if(countmjh >= size3 ) { return -1; } 2023-10-17T18:27:54,397 | ~~~~~~~~~^~~~~~~~ 2023-10-17T18:27:54,398 moleculekit/xtc_utils/src/xdrfile.cpp:951:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,398 951 | if(countmjh >= size3 ) { return -1; } 2023-10-17T18:27:54,398 | ~~~~~~~~~^~~~~~~~ 2023-10-17T18:27:54,399 moleculekit/xtc_utils/src/xdrfile.cpp:756:17: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2023-10-17T18:27:54,399 756 | int smallidx, minidx, maxidx; 2023-10-17T18:27:54,399 | ^~~~~~ 2023-10-17T18:27:54,400 moleculekit/xtc_utils/src/xdrfile.cpp:759:25: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2023-10-17T18:27:54,400 759 | int smallnum, smaller, larger, i, is_smaller, run; 2023-10-17T18:27:54,400 | ^~~~~~ 2023-10-17T18:27:54,400 moleculekit/xtc_utils/src/xdrfile.cpp:763:6: warning: unused variable ‘errval’ [-Wunused-variable] 2023-10-17T18:27:54,400 763 | int errval=1; 2023-10-17T18:27:54,400 | ^~~~~~ 2023-10-17T18:27:54,403 moleculekit/xtc_utils/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2023-10-17T18:27:54,403 moleculekit/xtc_utils/src/xdrfile.cpp:1011:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2023-10-17T18:27:54,404 1011 | if(size3>xfp->buf1size) 2023-10-17T18:27:54,404 | ~~~~~^~~~~~~~~~~~~~ 2023-10-17T18:27:54,406 moleculekit/xtc_utils/src/xdrfile.cpp:1068:29: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,406 1068 | countmjh++; if( countmjh> size3) { return -1; } 2023-10-17T18:27:54,406 | ~~~~~~~~^~~~~~~ 2023-10-17T18:27:54,407 moleculekit/xtc_utils/src/xdrfile.cpp:1084:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,407 1084 | countmjh++; if( countmjh> size3) { return -1; } 2023-10-17T18:27:54,407 | ~~~~~~~~^~~~~~~ 2023-10-17T18:27:54,407 moleculekit/xtc_utils/src/xdrfile.cpp:1098:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,408 1098 | countmjh++; if( countmjh> size3) { return -1; } 2023-10-17T18:27:54,408 | ~~~~~~~~^~~~~~~ 2023-10-17T18:27:54,409 moleculekit/xtc_utils/src/xdrfile.cpp:1137:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,409 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2023-10-17T18:27:54,409 | ^ 2023-10-17T18:27:54,410 moleculekit/xtc_utils/src/xdrfile.cpp:1143:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2023-10-17T18:27:54,410 1143 | maxidx = (LASTIDXxfp->buf1size) 2023-10-17T18:27:54,417 | ~~~~~^~~~~~~~~~~~~~ 2023-10-17T18:27:54,418 moleculekit/xtc_utils/src/xdrfile.cpp:1377:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2023-10-17T18:27:54,419 1377 | maxidx = (LASTIDXxfp->buf1size) { 2023-10-17T18:27:54,424 | ~~~~~^~~~~~~~~~~~~~ 2023-10-17T18:27:54,428 moleculekit/xtc_utils/src/xdrfile.cpp:1628:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2023-10-17T18:27:54,428 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2023-10-17T18:27:54,428 | ^ 2023-10-17T18:27:54,429 moleculekit/xtc_utils/src/xdrfile.cpp:1633:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2023-10-17T18:27:54,429 1633 | maxidx = (LASTIDX::_M_realloc_insert(std::vector<_Tp, _Alloc>::iterator, _Args&& ...) [with _Args = {const double&}; _Tp = double; _Alloc = std::allocator]’: 2023-10-17T18:29:06,882 /usr/include/c++/10/bits/vector.tcc:426:7: note: parameter passing for argument of type ‘std::vector::iterator’ changed in GCC 7.1 2023-10-17T18:29:06,882 426 | vector<_Tp, _Alloc>:: 2023-10-17T18:29:06,882 | ^~~~~~~~~~~~~~~~~~~ 2023-10-17T18:29:07,459 In file included from /usr/include/c++/10/vector:67, 2023-10-17T18:29:07,459 from moleculekit/tmalign/tmalign_util.cpp:1234: 2023-10-17T18:29:07,459 /usr/include/c++/10/bits/stl_vector.h: In function ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2023-10-17T18:29:07,459 /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 2023-10-17T18:29:07,459 1198 | _M_realloc_insert(end(), __x); 2023-10-17T18:29:07,459 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2023-10-17T18:29:07,460 /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 2023-10-17T18:29:07,460 1198 | _M_realloc_insert(end(), __x); 2023-10-17T18:29:07,460 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2023-10-17T18:29:07,462 /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 2023-10-17T18:29:07,462 1198 | _M_realloc_insert(end(), __x); 2023-10-17T18:29:07,462 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2023-10-17T18:29:09,918 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 2023-10-17T18:29:10,361 UPDATING build/lib.linux-armv7l-cpython-39/moleculekit/_version.py 2023-10-17T18:29:10,362 set build/lib.linux-armv7l-cpython-39/moleculekit/_version.py to '1.8.3' 2023-10-17T18:29:10,362 installing to build/bdist.linux-armv7l/wheel 2023-10-17T18:29:10,362 running install 2023-10-17T18:29:10,387 running install_lib 2023-10-17T18:29:10,393 creating build/bdist.linux-armv7l 2023-10-17T18:29:10,394 creating build/bdist.linux-armv7l/wheel 2023-10-17T18:29:10,396 creating build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:10,397 copying build/lib.linux-armv7l-cpython-39/moleculekit/util.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:10,400 copying build/lib.linux-armv7l-cpython-39/moleculekit/version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:10,402 creating build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2023-10-17T18:29:10,403 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2023-10-17T18:29:10,431 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2023-10-17T18:29:10,433 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:10,453 copying build/lib.linux-armv7l-cpython-39/moleculekit/home.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:10,454 copying build/lib.linux-armv7l-cpython-39/moleculekit/viewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:10,457 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2023-10-17T18:29:10,458 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2023-10-17T18:29:10,460 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2023-10-17T18:29:10,484 creating build/bdist.linux-armv7l/wheel/moleculekit/share 2023-10-17T18:29:10,485 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/opm_sequences.json -> build/bdist.linux-armv7l/wheel/moleculekit/share 2023-10-17T18:29:10,679 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr 2023-10-17T18:29:10,683 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,684 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TPO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,685 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/004.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,687 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,689 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,690 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OMX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,692 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,694 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,695 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HYP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,697 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/D4P.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,699 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/1MH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,700 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,702 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,704 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BTK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,706 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2GX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,707 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/KYN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,709 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/KYN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,711 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/.gitkeep -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,712 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,714 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,715 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,717 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AA4.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,719 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HHK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,721 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NZC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,722 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,724 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/03Y.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,726 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/5JP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,727 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ME0.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,729 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,731 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,732 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AA4.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,734 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,736 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAB.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,737 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2GX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,739 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,741 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,742 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,744 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IIL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,746 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BB8.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,747 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,749 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DA2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,750 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,752 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NAL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,754 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DPP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,755 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YCM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,757 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TPO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,759 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/5JP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,760 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TRO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,762 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,764 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CGU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,765 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/APD.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,767 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HQA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,768 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,770 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,772 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ONL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,773 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,775 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ONL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,776 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YNM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,778 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PCA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,780 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,781 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,783 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YCM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,785 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,786 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2MR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,788 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ESC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,789 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,791 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,793 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/D4P.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,794 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,796 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,797 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,799 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GHG.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,801 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HOX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,802 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0BN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,804 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ORM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,805 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,807 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AHP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,809 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,810 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,812 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/FGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,814 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,815 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/SEP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,817 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,818 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,820 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,822 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,823 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YNM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,825 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,827 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,828 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,830 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,832 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HHK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,834 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,835 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/M3L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,837 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,839 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AHP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,840 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/I2M.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,842 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,844 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0A1.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,845 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/03Y.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,847 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,848 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,851 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OMX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,853 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2MR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,855 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GNC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,857 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,859 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/I2M.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,861 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/P1L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,864 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/SEP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,866 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2ML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,868 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,870 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2AS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,872 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TRO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,874 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0AF.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,876 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/004.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,879 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CGU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,881 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ABA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,883 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ABA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,885 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAB.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,887 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TY2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,889 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,891 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,894 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,895 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,897 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,900 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NZC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,902 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GNC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,904 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DPP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,906 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,908 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PRK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,910 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,912 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0A1.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,914 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GHG.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,917 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,919 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4IN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,921 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HQA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,923 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2AS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,925 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PRK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,927 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,929 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,931 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,933 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,935 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,937 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/FGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,939 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HPE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,941 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,943 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IIL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,945 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BB8.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,947 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TY2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,949 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DA2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,951 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/1MH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,952 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HPE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,954 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ME0.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,956 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NAL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,957 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,959 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,961 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/P1L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,962 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0AF.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,964 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,966 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HYP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,967 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HOX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,969 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,971 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PCA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,972 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,974 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ORM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,976 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MMO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,977 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4IN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,979 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2ML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,981 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/M3L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,983 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0BN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,984 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,986 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ESC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,988 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MMO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,990 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/APD.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,991 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,993 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BTK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2023-10-17T18:29:10,995 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/ALA.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2023-10-17T18:29:10,997 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/backbone.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2023-10-17T18:29:10,999 creating build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2023-10-17T18:29:11,000 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect/atomselect.json -> build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2023-10-17T18:29:11,002 creating build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,003 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,005 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsasa.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,007 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsphericalcoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,009 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsecondarystructure.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,011 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricfluctuation.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,013 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricdistance.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,016 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metriccoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,018 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricshell.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,021 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,022 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metrictmscore.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,024 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricrmsd.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,026 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricdihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,029 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricplumed2.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,032 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricgyration.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,033 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/projection.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2023-10-17T18:29:11,035 copying build/lib.linux-armv7l-cpython-39/moleculekit/dihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,037 copying build/lib.linux-armv7l-cpython-39/moleculekit/logging.ini -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,038 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,040 copying build/lib.linux-armv7l-cpython-39/moleculekit/align.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,042 creating build/bdist.linux-armv7l/wheel/moleculekit/ply 2023-10-17T18:29:11,043 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/yacc.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2023-10-17T18:29:11,048 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2023-10-17T18:29:11,049 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/lex.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2023-10-17T18:29:11,053 creating build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils 2023-10-17T18:29:11,054 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/xtc.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils 2023-10-17T18:29:11,055 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/xtclib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils 2023-10-17T18:29:11,057 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils 2023-10-17T18:29:11,081 creating build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils/include 2023-10-17T18:29:11,082 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/include/xdrfile.h -> build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils/include 2023-10-17T18:29:11,085 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/include/xdrfile_xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils/include 2023-10-17T18:29:11,086 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/include/xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils/include 2023-10-17T18:29:11,088 creating build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils/src 2023-10-17T18:29:11,089 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/src/xdrfile_xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils/src 2023-10-17T18:29:11,091 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/src/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils/src 2023-10-17T18:29:11,093 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc_utils/src/xdrfile.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/xtc_utils/src 2023-10-17T18:29:11,097 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,115 copying build/lib.linux-armv7l-cpython-39/moleculekit/_version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,117 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions 2023-10-17T18:29:11,118 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2023-10-17T18:29:11,119 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2023-10-17T18:29:11,122 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2023-10-17T18:29:11,149 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/interactions.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2023-10-17T18:29:11,152 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2023-10-17T18:29:11,153 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2023-10-17T18:29:11,155 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2023-10-17T18:29:11,174 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2023-10-17T18:29:11,195 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2023-10-17T18:29:11,222 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2023-10-17T18:29:11,224 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2023-10-17T18:29:11,246 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2023-10-17T18:29:11,247 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2023-10-17T18:29:11,250 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2023-10-17T18:29:11,272 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2023-10-17T18:29:11,296 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2023-10-17T18:29:11,297 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2023-10-17T18:29:11,299 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2023-10-17T18:29:11,322 creating build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2023-10-17T18:29:11,322 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2023-10-17T18:29:11,343 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2023-10-17T18:29:11,346 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2023-10-17T18:29:11,347 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/analyze.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2023-10-17T18:29:11,349 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2023-10-17T18:29:11,351 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/atomselect.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2023-10-17T18:29:11,353 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/languageparser.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2023-10-17T18:29:11,355 copying build/lib.linux-armv7l-cpython-39/moleculekit/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,357 copying build/lib.linux-armv7l-cpython-39/moleculekit/periodictable.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,359 copying build/lib.linux-armv7l-cpython-39/moleculekit/readers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,363 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2023-10-17T18:29:11,365 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2023-10-17T18:29:11,366 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2023-10-17T18:29:11,368 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxWriterTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2023-10-17T18:29:11,370 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2023-10-17T18:29:11,371 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxReaderTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2023-10-17T18:29:11,373 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2023-10-17T18:29:11,375 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2023-10-17T18:29:11,376 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxParser.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2023-10-17T18:29:11,378 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxContainers.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2023-10-17T18:29:11,381 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2023-10-17T18:29:11,382 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxReader.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2023-10-17T18:29:11,385 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2023-10-17T18:29:11,386 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2023-10-17T18:29:11,387 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer/PdbxWriter.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2023-10-17T18:29:11,389 copying build/lib.linux-armv7l-cpython-39/moleculekit/rcsb.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,391 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,394 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2023-10-17T18:29:11,394 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2023-10-17T18:29:11,397 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/test_smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2023-10-17T18:29:11,399 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2023-10-17T18:29:11,401 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2023-10-17T18:29:11,402 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/clustering.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2023-10-17T18:29:11,404 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/restrainedembed.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2023-10-17T18:29:11,406 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2023-10-17T18:29:11,407 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/test_tools.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2023-10-17T18:29:11,409 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2023-10-17T18:29:11,412 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/test_smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2023-10-17T18:29:11,414 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2023-10-17T18:29:11,417 copying build/lib.linux-armv7l-cpython-39/moleculekit/config.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,419 creating build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2023-10-17T18:29:11,420 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2023-10-17T18:29:11,422 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2023-10-17T18:29:11,446 copying build/lib.linux-armv7l-cpython-39/moleculekit/opm.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,449 creating build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,450 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/preparation.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,454 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/sequencestructuralalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,456 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/preparation_customres.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,458 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/docking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,461 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/voxeldescriptors.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,464 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/atomtyper.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,466 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/hhblitsprofile.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,469 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,471 creating build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2023-10-17T18:29:11,472 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2023-10-17T18:29:11,474 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools/obabel_cli.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2023-10-17T18:29:11,476 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/crystalpacking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,478 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/graphalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,481 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/detect.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,484 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/moleculechecks.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,486 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/autosegment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2023-10-17T18:29:11,489 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2023-10-17T18:29:11,490 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2023-10-17T18:29:11,512 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalignlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2023-10-17T18:29:11,514 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2023-10-17T18:29:11,515 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include/TMAlign.h -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2023-10-17T18:29:11,517 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2023-10-17T18:29:11,519 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2023-10-17T18:29:11,520 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src/TMAlign.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2023-10-17T18:29:11,526 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,547 copying build/lib.linux-armv7l-cpython-39/moleculekit/rdkitintegration.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,549 creating build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2023-10-17T18:29:11,550 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2023-10-17T18:29:11,567 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2023-10-17T18:29:11,569 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,587 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmdviewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,589 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,623 copying build/lib.linux-armv7l-cpython-39/moleculekit/writers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,626 copying build/lib.linux-armv7l-cpython-39/moleculekit/molecule.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,629 copying build/lib.linux-armv7l-cpython-39/moleculekit/pymolgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,631 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,687 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmd_wrapper -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,689 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,724 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmdgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2023-10-17T18:29:11,726 running install_egg_info 2023-10-17T18:29:11,734 Copying moleculekit.egg-info to build/bdist.linux-armv7l/wheel/moleculekit-1.8.3-py3.9.egg-info 2023-10-17T18:29:11,750 running install_scripts 2023-10-17T18:29:11,801 creating build/bdist.linux-armv7l/wheel/moleculekit-1.8.3.dist-info/WHEEL 2023-10-17T18:29:11,804 creating '/tmp/pip-wheel-0u2zlg70/.tmp-6kphze7o/moleculekit-1.8.3-cp39-cp39-linux_armv7l.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2023-10-17T18:29:11,807 adding 'moleculekit/__init__.py' 2023-10-17T18:29:11,808 adding 'moleculekit/_version.py' 2023-10-17T18:29:11,810 adding 'moleculekit/align.py' 2023-10-17T18:29:12,124 adding 'moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:12,136 adding 'moleculekit/bondguesser.py' 2023-10-17T18:29:12,376 adding 'moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:12,385 adding 'moleculekit/config.py' 2023-10-17T18:29:12,387 adding 'moleculekit/dihedral.py' 2023-10-17T18:29:12,388 adding 'moleculekit/distance.py' 2023-10-17T18:29:12,695 adding 'moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:12,706 adding 'moleculekit/home.py' 2023-10-17T18:29:12,707 adding 'moleculekit/logging.ini' 2023-10-17T18:29:12,721 adding 'moleculekit/molecule.py' 2023-10-17T18:29:12,945 adding 'moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:12,954 adding 'moleculekit/opm.py' 2023-10-17T18:29:12,956 adding 'moleculekit/periodictable.py' 2023-10-17T18:29:12,957 adding 'moleculekit/pymolgraphics.py' 2023-10-17T18:29:12,958 adding 'moleculekit/rcsb.py' 2023-10-17T18:29:12,960 adding 'moleculekit/rdkitintegration.py' 2023-10-17T18:29:12,972 adding 'moleculekit/readers.py' 2023-10-17T18:29:13,574 adding 'moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:13,598 adding 'moleculekit/util.py' 2023-10-17T18:29:13,600 adding 'moleculekit/version.py' 2023-10-17T18:29:13,602 adding 'moleculekit/viewer.py' 2023-10-17T18:29:13,603 adding 'moleculekit/vmd_wrapper' 2023-10-17T18:29:13,605 adding 'moleculekit/vmdgraphics.py' 2023-10-17T18:29:13,607 adding 'moleculekit/vmdviewer.py' 2023-10-17T18:29:13,839 adding 'moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:13,851 adding 'moleculekit/writers.py' 2023-10-17T18:29:14,116 adding 'moleculekit/xtc.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:14,126 adding 'moleculekit/atomselect/__init__.py' 2023-10-17T18:29:14,127 adding 'moleculekit/atomselect/analyze.py' 2023-10-17T18:29:14,129 adding 'moleculekit/atomselect/atomselect.py' 2023-10-17T18:29:14,132 adding 'moleculekit/atomselect/languageparser.py' 2023-10-17T18:29:14,236 adding 'moleculekit/atomselect_utils/atomselect_utils.cpp' 2023-10-17T18:29:14,247 adding 'moleculekit/atomselect_utils/atomselect_utils.pyx' 2023-10-17T18:29:14,338 adding 'moleculekit/bondguesser_utils/bondguesser_utils.cpp' 2023-10-17T18:29:14,347 adding 'moleculekit/bondguesser_utils/bondguesser_utils.pyx' 2023-10-17T18:29:14,446 adding 'moleculekit/distance_utils/distance_utils.cpp' 2023-10-17T18:29:14,456 adding 'moleculekit/distance_utils/distance_utils.pyx' 2023-10-17T18:29:14,458 adding 'moleculekit/interactions/__init__.py' 2023-10-17T18:29:14,744 adding 'moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:15,014 adding 'moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:15,025 adding 'moleculekit/interactions/interactions.py' 2023-10-17T18:29:15,303 adding 'moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:15,589 adding 'moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so' 2023-10-17T18:29:15,690 adding 'moleculekit/interactions/cationpi/cationpi.cpp' 2023-10-17T18:29:15,699 adding 'moleculekit/interactions/cationpi/cationpi.pyx' 2023-10-17T18:29:15,790 adding 'moleculekit/interactions/hbonds/hbonds.cpp' 2023-10-17T18:29:15,799 adding 'moleculekit/interactions/hbonds/hbonds.pyx' 2023-10-17T18:29:15,891 adding 'moleculekit/interactions/pipi/pipi.cpp' 2023-10-17T18:29:15,900 adding 'moleculekit/interactions/pipi/pipi.pyx' 2023-10-17T18:29:15,992 adding 'moleculekit/interactions/sigmahole/sigmahole.cpp' 2023-10-17T18:29:16,002 adding 'moleculekit/interactions/sigmahole/sigmahole.pyx' 2023-10-17T18:29:16,090 adding 'moleculekit/occupancy_utils/occupancy_utils.cpp' 2023-10-17T18:29:16,098 adding 'moleculekit/occupancy_utils/occupancy_utils.pyx' 2023-10-17T18:29:16,100 adding 'moleculekit/pdbx/__init__.py' 2023-10-17T18:29:16,103 adding 'moleculekit/pdbx/reader/PdbxContainers.py' 2023-10-17T18:29:16,106 adding 'moleculekit/pdbx/reader/PdbxParser.py' 2023-10-17T18:29:16,108 adding 'moleculekit/pdbx/reader/PdbxReader.py' 2023-10-17T18:29:16,110 adding 'moleculekit/pdbx/reader/__init__.py' 2023-10-17T18:29:16,112 adding 'moleculekit/pdbx/tests/PdbxReadWriteTests.py' 2023-10-17T18:29:16,113 adding 'moleculekit/pdbx/tests/PdbxReaderTests.py' 2023-10-17T18:29:16,115 adding 'moleculekit/pdbx/tests/PdbxWriterTests.py' 2023-10-17T18:29:16,116 adding 'moleculekit/pdbx/tests/__init__.py' 2023-10-17T18:29:16,118 adding 'moleculekit/pdbx/writer/PdbxWriter.py' 2023-10-17T18:29:16,119 adding 'moleculekit/pdbx/writer/__init__.py' 2023-10-17T18:29:16,121 adding 'moleculekit/ply/__init__.py' 2023-10-17T18:29:16,125 adding 'moleculekit/ply/lex.py' 2023-10-17T18:29:16,137 adding 'moleculekit/ply/yacc.py' 2023-10-17T18:29:16,139 adding 'moleculekit/projections/__init__.py' 2023-10-17T18:29:16,141 adding 'moleculekit/projections/metriccoordinate.py' 2023-10-17T18:29:16,145 adding 'moleculekit/projections/metricdihedral.py' 2023-10-17T18:29:16,149 adding 'moleculekit/projections/metricdistance.py' 2023-10-17T18:29:16,151 adding 'moleculekit/projections/metricfluctuation.py' 2023-10-17T18:29:16,153 adding 'moleculekit/projections/metricgyration.py' 2023-10-17T18:29:16,156 adding 'moleculekit/projections/metricplumed2.py' 2023-10-17T18:29:16,158 adding 'moleculekit/projections/metricrmsd.py' 2023-10-17T18:29:16,160 adding 'moleculekit/projections/metricsasa.py' 2023-10-17T18:29:16,162 adding 'moleculekit/projections/metricsecondarystructure.py' 2023-10-17T18:29:16,164 adding 'moleculekit/projections/metricshell.py' 2023-10-17T18:29:16,166 adding 'moleculekit/projections/metricsphericalcoordinate.py' 2023-10-17T18:29:16,167 adding 'moleculekit/projections/metrictmscore.py' 2023-10-17T18:29:16,168 adding 'moleculekit/projections/projection.py' 2023-10-17T18:29:16,174 adding 'moleculekit/projections/util.py' 2023-10-17T18:29:16,176 adding 'moleculekit/share/ALA.cif' 2023-10-17T18:29:16,177 adding 'moleculekit/share/backbone.cif' 2023-10-17T18:29:17,483 adding 'moleculekit/share/opm_sequences.json' 2023-10-17T18:29:17,568 adding 'moleculekit/share/atomselect/atomselect.json' 2023-10-17T18:29:17,573 adding 'moleculekit/share/pdb2pqr/residues/.gitkeep' 2023-10-17T18:29:17,574 adding 'moleculekit/share/pdb2pqr/residues/004.dat' 2023-10-17T18:29:17,576 adding 'moleculekit/share/pdb2pqr/residues/004.xml' 2023-10-17T18:29:17,577 adding 'moleculekit/share/pdb2pqr/residues/03Y.dat' 2023-10-17T18:29:17,578 adding 'moleculekit/share/pdb2pqr/residues/03Y.xml' 2023-10-17T18:29:17,580 adding 'moleculekit/share/pdb2pqr/residues/0A1.dat' 2023-10-17T18:29:17,581 adding 'moleculekit/share/pdb2pqr/residues/0A1.xml' 2023-10-17T18:29:17,582 adding 'moleculekit/share/pdb2pqr/residues/0AF.dat' 2023-10-17T18:29:17,583 adding 'moleculekit/share/pdb2pqr/residues/0AF.xml' 2023-10-17T18:29:17,585 adding 'moleculekit/share/pdb2pqr/residues/0BN.dat' 2023-10-17T18:29:17,586 adding 'moleculekit/share/pdb2pqr/residues/0BN.xml' 2023-10-17T18:29:17,587 adding 'moleculekit/share/pdb2pqr/residues/1MH.dat' 2023-10-17T18:29:17,588 adding 'moleculekit/share/pdb2pqr/residues/1MH.xml' 2023-10-17T18:29:17,590 adding 'moleculekit/share/pdb2pqr/residues/2AS.dat' 2023-10-17T18:29:17,591 adding 'moleculekit/share/pdb2pqr/residues/2AS.xml' 2023-10-17T18:29:17,592 adding 'moleculekit/share/pdb2pqr/residues/2GX.dat' 2023-10-17T18:29:17,594 adding 'moleculekit/share/pdb2pqr/residues/2GX.xml' 2023-10-17T18:29:17,595 adding 'moleculekit/share/pdb2pqr/residues/2ML.dat' 2023-10-17T18:29:17,596 adding 'moleculekit/share/pdb2pqr/residues/2ML.xml' 2023-10-17T18:29:17,597 adding 'moleculekit/share/pdb2pqr/residues/2MR.dat' 2023-10-17T18:29:17,599 adding 'moleculekit/share/pdb2pqr/residues/2MR.xml' 2023-10-17T18:29:17,600 adding 'moleculekit/share/pdb2pqr/residues/4IN.dat' 2023-10-17T18:29:17,601 adding 'moleculekit/share/pdb2pqr/residues/4IN.xml' 2023-10-17T18:29:17,603 adding 'moleculekit/share/pdb2pqr/residues/4PH.dat' 2023-10-17T18:29:17,604 adding 'moleculekit/share/pdb2pqr/residues/4PH.xml' 2023-10-17T18:29:17,605 adding 'moleculekit/share/pdb2pqr/residues/4PQ.dat' 2023-10-17T18:29:17,607 adding 'moleculekit/share/pdb2pqr/residues/4PQ.xml' 2023-10-17T18:29:17,608 adding 'moleculekit/share/pdb2pqr/residues/5JP.dat' 2023-10-17T18:29:17,609 adding 'moleculekit/share/pdb2pqr/residues/5JP.xml' 2023-10-17T18:29:17,611 adding 'moleculekit/share/pdb2pqr/residues/AA4.dat' 2023-10-17T18:29:17,612 adding 'moleculekit/share/pdb2pqr/residues/AA4.xml' 2023-10-17T18:29:17,613 adding 'moleculekit/share/pdb2pqr/residues/ABA.dat' 2023-10-17T18:29:17,614 adding 'moleculekit/share/pdb2pqr/residues/ABA.xml' 2023-10-17T18:29:17,615 adding 'moleculekit/share/pdb2pqr/residues/AHP.dat' 2023-10-17T18:29:17,617 adding 'moleculekit/share/pdb2pqr/residues/AHP.xml' 2023-10-17T18:29:17,618 adding 'moleculekit/share/pdb2pqr/residues/ALC.dat' 2023-10-17T18:29:17,620 adding 'moleculekit/share/pdb2pqr/residues/ALC.xml' 2023-10-17T18:29:17,621 adding 'moleculekit/share/pdb2pqr/residues/ALN.dat' 2023-10-17T18:29:17,622 adding 'moleculekit/share/pdb2pqr/residues/ALN.xml' 2023-10-17T18:29:17,623 adding 'moleculekit/share/pdb2pqr/residues/ALY.dat' 2023-10-17T18:29:17,625 adding 'moleculekit/share/pdb2pqr/residues/ALY.xml' 2023-10-17T18:29:17,626 adding 'moleculekit/share/pdb2pqr/residues/APD.dat' 2023-10-17T18:29:17,627 adding 'moleculekit/share/pdb2pqr/residues/APD.xml' 2023-10-17T18:29:17,629 adding 'moleculekit/share/pdb2pqr/residues/BB8.dat' 2023-10-17T18:29:17,630 adding 'moleculekit/share/pdb2pqr/residues/BB8.xml' 2023-10-17T18:29:17,631 adding 'moleculekit/share/pdb2pqr/residues/BCS.dat' 2023-10-17T18:29:17,632 adding 'moleculekit/share/pdb2pqr/residues/BCS.xml' 2023-10-17T18:29:17,634 adding 'moleculekit/share/pdb2pqr/residues/BTK.dat' 2023-10-17T18:29:17,635 adding 'moleculekit/share/pdb2pqr/residues/BTK.xml' 2023-10-17T18:29:17,636 adding 'moleculekit/share/pdb2pqr/residues/CCS.dat' 2023-10-17T18:29:17,638 adding 'moleculekit/share/pdb2pqr/residues/CCS.xml' 2023-10-17T18:29:17,639 adding 'moleculekit/share/pdb2pqr/residues/CGU.dat' 2023-10-17T18:29:17,640 adding 'moleculekit/share/pdb2pqr/residues/CGU.xml' 2023-10-17T18:29:17,641 adding 'moleculekit/share/pdb2pqr/residues/CSA.dat' 2023-10-17T18:29:17,643 adding 'moleculekit/share/pdb2pqr/residues/CSA.xml' 2023-10-17T18:29:17,644 adding 'moleculekit/share/pdb2pqr/residues/CSO.dat' 2023-10-17T18:29:17,645 adding 'moleculekit/share/pdb2pqr/residues/CSO.xml' 2023-10-17T18:29:17,646 adding 'moleculekit/share/pdb2pqr/residues/CSP.dat' 2023-10-17T18:29:17,648 adding 'moleculekit/share/pdb2pqr/residues/CSP.xml' 2023-10-17T18:29:17,649 adding 'moleculekit/share/pdb2pqr/residues/CSS.dat' 2023-10-17T18:29:17,650 adding 'moleculekit/share/pdb2pqr/residues/CSS.xml' 2023-10-17T18:29:17,651 adding 'moleculekit/share/pdb2pqr/residues/D4P.dat' 2023-10-17T18:29:17,653 adding 'moleculekit/share/pdb2pqr/residues/D4P.xml' 2023-10-17T18:29:17,654 adding 'moleculekit/share/pdb2pqr/residues/DA2.dat' 2023-10-17T18:29:17,655 adding 'moleculekit/share/pdb2pqr/residues/DA2.xml' 2023-10-17T18:29:17,657 adding 'moleculekit/share/pdb2pqr/residues/DAB.dat' 2023-10-17T18:29:17,658 adding 'moleculekit/share/pdb2pqr/residues/DAB.xml' 2023-10-17T18:29:17,659 adding 'moleculekit/share/pdb2pqr/residues/DAH.dat' 2023-10-17T18:29:17,660 adding 'moleculekit/share/pdb2pqr/residues/DAH.xml' 2023-10-17T18:29:17,662 adding 'moleculekit/share/pdb2pqr/residues/DPP.dat' 2023-10-17T18:29:17,663 adding 'moleculekit/share/pdb2pqr/residues/DPP.xml' 2023-10-17T18:29:17,664 adding 'moleculekit/share/pdb2pqr/residues/ESC.dat' 2023-10-17T18:29:17,665 adding 'moleculekit/share/pdb2pqr/residues/ESC.xml' 2023-10-17T18:29:17,666 adding 'moleculekit/share/pdb2pqr/residues/FGL.dat' 2023-10-17T18:29:17,668 adding 'moleculekit/share/pdb2pqr/residues/FGL.xml' 2023-10-17T18:29:17,669 adding 'moleculekit/share/pdb2pqr/residues/GHG.dat' 2023-10-17T18:29:17,670 adding 'moleculekit/share/pdb2pqr/residues/GHG.xml' 2023-10-17T18:29:17,672 adding 'moleculekit/share/pdb2pqr/residues/GME.dat' 2023-10-17T18:29:17,673 adding 'moleculekit/share/pdb2pqr/residues/GME.xml' 2023-10-17T18:29:17,674 adding 'moleculekit/share/pdb2pqr/residues/GNC.dat' 2023-10-17T18:29:17,675 adding 'moleculekit/share/pdb2pqr/residues/GNC.xml' 2023-10-17T18:29:17,677 adding 'moleculekit/share/pdb2pqr/residues/HHK.dat' 2023-10-17T18:29:17,678 adding 'moleculekit/share/pdb2pqr/residues/HHK.xml' 2023-10-17T18:29:17,679 adding 'moleculekit/share/pdb2pqr/residues/HLU.dat' 2023-10-17T18:29:17,681 adding 'moleculekit/share/pdb2pqr/residues/HLU.xml' 2023-10-17T18:29:17,682 adding 'moleculekit/share/pdb2pqr/residues/HLX.dat' 2023-10-17T18:29:17,683 adding 'moleculekit/share/pdb2pqr/residues/HLX.xml' 2023-10-17T18:29:17,684 adding 'moleculekit/share/pdb2pqr/residues/HOX.dat' 2023-10-17T18:29:17,686 adding 'moleculekit/share/pdb2pqr/residues/HOX.xml' 2023-10-17T18:29:17,687 adding 'moleculekit/share/pdb2pqr/residues/HPE.dat' 2023-10-17T18:29:17,688 adding 'moleculekit/share/pdb2pqr/residues/HPE.xml' 2023-10-17T18:29:17,690 adding 'moleculekit/share/pdb2pqr/residues/HQA.dat' 2023-10-17T18:29:17,691 adding 'moleculekit/share/pdb2pqr/residues/HQA.xml' 2023-10-17T18:29:17,692 adding 'moleculekit/share/pdb2pqr/residues/HTR.dat' 2023-10-17T18:29:17,694 adding 'moleculekit/share/pdb2pqr/residues/HTR.xml' 2023-10-17T18:29:17,695 adding 'moleculekit/share/pdb2pqr/residues/HYP.dat' 2023-10-17T18:29:17,696 adding 'moleculekit/share/pdb2pqr/residues/HYP.xml' 2023-10-17T18:29:17,697 adding 'moleculekit/share/pdb2pqr/residues/I2M.dat' 2023-10-17T18:29:17,699 adding 'moleculekit/share/pdb2pqr/residues/I2M.xml' 2023-10-17T18:29:17,700 adding 'moleculekit/share/pdb2pqr/residues/IGL.dat' 2023-10-17T18:29:17,701 adding 'moleculekit/share/pdb2pqr/residues/IGL.xml' 2023-10-17T18:29:17,702 adding 'moleculekit/share/pdb2pqr/residues/IIL.dat' 2023-10-17T18:29:17,704 adding 'moleculekit/share/pdb2pqr/residues/IIL.xml' 2023-10-17T18:29:17,705 adding 'moleculekit/share/pdb2pqr/residues/IML.dat' 2023-10-17T18:29:17,706 adding 'moleculekit/share/pdb2pqr/residues/IML.xml' 2023-10-17T18:29:17,708 adding 'moleculekit/share/pdb2pqr/residues/KYN.dat' 2023-10-17T18:29:17,709 adding 'moleculekit/share/pdb2pqr/residues/KYN.xml' 2023-10-17T18:29:17,710 adding 'moleculekit/share/pdb2pqr/residues/LME.dat' 2023-10-17T18:29:17,712 adding 'moleculekit/share/pdb2pqr/residues/LME.xml' 2023-10-17T18:29:17,713 adding 'moleculekit/share/pdb2pqr/residues/LMQ.dat' 2023-10-17T18:29:17,714 adding 'moleculekit/share/pdb2pqr/residues/LMQ.xml' 2023-10-17T18:29:17,715 adding 'moleculekit/share/pdb2pqr/residues/LYZ.dat' 2023-10-17T18:29:17,717 adding 'moleculekit/share/pdb2pqr/residues/LYZ.xml' 2023-10-17T18:29:17,718 adding 'moleculekit/share/pdb2pqr/residues/M3L.dat' 2023-10-17T18:29:17,719 adding 'moleculekit/share/pdb2pqr/residues/M3L.xml' 2023-10-17T18:29:17,720 adding 'moleculekit/share/pdb2pqr/residues/ME0.dat' 2023-10-17T18:29:17,722 adding 'moleculekit/share/pdb2pqr/residues/ME0.xml' 2023-10-17T18:29:17,723 adding 'moleculekit/share/pdb2pqr/residues/MEA.dat' 2023-10-17T18:29:17,724 adding 'moleculekit/share/pdb2pqr/residues/MEA.xml' 2023-10-17T18:29:17,726 adding 'moleculekit/share/pdb2pqr/residues/MEN.dat' 2023-10-17T18:29:17,727 adding 'moleculekit/share/pdb2pqr/residues/MEN.xml' 2023-10-17T18:29:17,728 adding 'moleculekit/share/pdb2pqr/residues/MEQ.dat' 2023-10-17T18:29:17,729 adding 'moleculekit/share/pdb2pqr/residues/MEQ.xml' 2023-10-17T18:29:17,731 adding 'moleculekit/share/pdb2pqr/residues/MLE.dat' 2023-10-17T18:29:17,734 adding 'moleculekit/share/pdb2pqr/residues/MLE.xml' 2023-10-17T18:29:17,735 adding 'moleculekit/share/pdb2pqr/residues/MLY.dat' 2023-10-17T18:29:17,736 adding 'moleculekit/share/pdb2pqr/residues/MLY.xml' 2023-10-17T18:29:17,738 adding 'moleculekit/share/pdb2pqr/residues/MLZ.dat' 2023-10-17T18:29:17,739 adding 'moleculekit/share/pdb2pqr/residues/MLZ.xml' 2023-10-17T18:29:17,740 adding 'moleculekit/share/pdb2pqr/residues/MME.dat' 2023-10-17T18:29:17,742 adding 'moleculekit/share/pdb2pqr/residues/MME.xml' 2023-10-17T18:29:17,743 adding 'moleculekit/share/pdb2pqr/residues/MMO.dat' 2023-10-17T18:29:17,744 adding 'moleculekit/share/pdb2pqr/residues/MMO.xml' 2023-10-17T18:29:17,745 adding 'moleculekit/share/pdb2pqr/residues/MVA.dat' 2023-10-17T18:29:17,747 adding 'moleculekit/share/pdb2pqr/residues/MVA.xml' 2023-10-17T18:29:17,748 adding 'moleculekit/share/pdb2pqr/residues/NAL.dat' 2023-10-17T18:29:17,749 adding 'moleculekit/share/pdb2pqr/residues/NAL.xml' 2023-10-17T18:29:17,750 adding 'moleculekit/share/pdb2pqr/residues/NCY.dat' 2023-10-17T18:29:17,752 adding 'moleculekit/share/pdb2pqr/residues/NCY.xml' 2023-10-17T18:29:17,753 adding 'moleculekit/share/pdb2pqr/residues/NLE.dat' 2023-10-17T18:29:17,754 adding 'moleculekit/share/pdb2pqr/residues/NLE.xml' 2023-10-17T18:29:17,755 adding 'moleculekit/share/pdb2pqr/residues/NVA.dat' 2023-10-17T18:29:17,757 adding 'moleculekit/share/pdb2pqr/residues/NVA.xml' 2023-10-17T18:29:17,758 adding 'moleculekit/share/pdb2pqr/residues/NZC.dat' 2023-10-17T18:29:17,759 adding 'moleculekit/share/pdb2pqr/residues/NZC.xml' 2023-10-17T18:29:17,760 adding 'moleculekit/share/pdb2pqr/residues/OCY.dat' 2023-10-17T18:29:17,762 adding 'moleculekit/share/pdb2pqr/residues/OCY.xml' 2023-10-17T18:29:17,763 adding 'moleculekit/share/pdb2pqr/residues/OMX.dat' 2023-10-17T18:29:17,764 adding 'moleculekit/share/pdb2pqr/residues/OMX.xml' 2023-10-17T18:29:17,766 adding 'moleculekit/share/pdb2pqr/residues/ONL.dat' 2023-10-17T18:29:17,767 adding 'moleculekit/share/pdb2pqr/residues/ONL.xml' 2023-10-17T18:29:17,768 adding 'moleculekit/share/pdb2pqr/residues/ORM.dat' 2023-10-17T18:29:17,769 adding 'moleculekit/share/pdb2pqr/residues/ORM.xml' 2023-10-17T18:29:17,771 adding 'moleculekit/share/pdb2pqr/residues/P1L.dat' 2023-10-17T18:29:17,772 adding 'moleculekit/share/pdb2pqr/residues/P1L.xml' 2023-10-17T18:29:17,774 adding 'moleculekit/share/pdb2pqr/residues/PCA.dat' 2023-10-17T18:29:17,775 adding 'moleculekit/share/pdb2pqr/residues/PCA.xml' 2023-10-17T18:29:17,776 adding 'moleculekit/share/pdb2pqr/residues/PRK.dat' 2023-10-17T18:29:17,778 adding 'moleculekit/share/pdb2pqr/residues/PRK.xml' 2023-10-17T18:29:17,779 adding 'moleculekit/share/pdb2pqr/residues/PTR.dat' 2023-10-17T18:29:17,780 adding 'moleculekit/share/pdb2pqr/residues/PTR.xml' 2023-10-17T18:29:17,781 adding 'moleculekit/share/pdb2pqr/residues/SEP.dat' 2023-10-17T18:29:17,783 adding 'moleculekit/share/pdb2pqr/residues/SEP.xml' 2023-10-17T18:29:17,784 adding 'moleculekit/share/pdb2pqr/residues/TPO.dat' 2023-10-17T18:29:17,785 adding 'moleculekit/share/pdb2pqr/residues/TPO.xml' 2023-10-17T18:29:17,786 adding 'moleculekit/share/pdb2pqr/residues/TRO.dat' 2023-10-17T18:29:17,788 adding 'moleculekit/share/pdb2pqr/residues/TRO.xml' 2023-10-17T18:29:17,789 adding 'moleculekit/share/pdb2pqr/residues/TY2.dat' 2023-10-17T18:29:17,790 adding 'moleculekit/share/pdb2pqr/residues/TY2.xml' 2023-10-17T18:29:17,791 adding 'moleculekit/share/pdb2pqr/residues/TYQ.dat' 2023-10-17T18:29:17,793 adding 'moleculekit/share/pdb2pqr/residues/TYQ.xml' 2023-10-17T18:29:17,794 adding 'moleculekit/share/pdb2pqr/residues/YCM.dat' 2023-10-17T18:29:17,795 adding 'moleculekit/share/pdb2pqr/residues/YCM.xml' 2023-10-17T18:29:17,796 adding 'moleculekit/share/pdb2pqr/residues/YNM.dat' 2023-10-17T18:29:17,798 adding 'moleculekit/share/pdb2pqr/residues/YNM.xml' 2023-10-17T18:29:17,800 adding 'moleculekit/smallmol/__init__.py' 2023-10-17T18:29:17,805 adding 'moleculekit/smallmol/smallmol.py' 2023-10-17T18:29:17,807 adding 'moleculekit/smallmol/smallmollib.py' 2023-10-17T18:29:17,809 adding 'moleculekit/smallmol/test_smallmol.py' 2023-10-17T18:29:17,811 adding 'moleculekit/smallmol/test_smallmollib.py' 2023-10-17T18:29:17,813 adding 'moleculekit/smallmol/util.py' 2023-10-17T18:29:17,815 adding 'moleculekit/smallmol/tools/__init__.py' 2023-10-17T18:29:17,817 adding 'moleculekit/smallmol/tools/clustering.py' 2023-10-17T18:29:17,818 adding 'moleculekit/smallmol/tools/restrainedembed.py' 2023-10-17T18:29:17,820 adding 'moleculekit/smallmol/tools/test_tools.py' 2023-10-17T18:29:17,910 adding 'moleculekit/tmalign/tmalign_util.cpp' 2023-10-17T18:29:17,919 adding 'moleculekit/tmalign/tmalign_util.pyx' 2023-10-17T18:29:17,920 adding 'moleculekit/tmalign/tmalignlib.pxd' 2023-10-17T18:29:17,922 adding 'moleculekit/tmalign/include/TMAlign.h' 2023-10-17T18:29:17,939 adding 'moleculekit/tmalign/src/TMAlign.cpp' 2023-10-17T18:29:17,942 adding 'moleculekit/tools/__init__.py' 2023-10-17T18:29:17,945 adding 'moleculekit/tools/atomtyper.py' 2023-10-17T18:29:17,947 adding 'moleculekit/tools/autosegment.py' 2023-10-17T18:29:17,949 adding 'moleculekit/tools/crystalpacking.py' 2023-10-17T18:29:17,953 adding 'moleculekit/tools/detect.py' 2023-10-17T18:29:17,955 adding 'moleculekit/tools/docking.py' 2023-10-17T18:29:17,956 adding 'moleculekit/tools/graphalignment.py' 2023-10-17T18:29:17,958 adding 'moleculekit/tools/hhblitsprofile.py' 2023-10-17T18:29:17,960 adding 'moleculekit/tools/moleculechecks.py' 2023-10-17T18:29:17,967 adding 'moleculekit/tools/preparation.py' 2023-10-17T18:29:17,969 adding 'moleculekit/tools/preparation_customres.py' 2023-10-17T18:29:17,971 adding 'moleculekit/tools/sequencestructuralalignment.py' 2023-10-17T18:29:17,974 adding 'moleculekit/tools/voxeldescriptors.py' 2023-10-17T18:29:17,977 adding 'moleculekit/tools/obabel_tools/__init__.py' 2023-10-17T18:29:17,978 adding 'moleculekit/tools/obabel_tools/obabel_cli.py' 2023-10-17T18:29:18,066 adding 'moleculekit/wrapping/wrapping.cpp' 2023-10-17T18:29:18,075 adding 'moleculekit/wrapping/wrapping.pyx' 2023-10-17T18:29:18,164 adding 'moleculekit/xtc_utils/xtc.cpp' 2023-10-17T18:29:18,173 adding 'moleculekit/xtc_utils/xtc.pyx' 2023-10-17T18:29:18,174 adding 'moleculekit/xtc_utils/xtclib.pxd' 2023-10-17T18:29:18,177 adding 'moleculekit/xtc_utils/include/xdrfile.h' 2023-10-17T18:29:18,179 adding 'moleculekit/xtc_utils/include/xdrfile_xtc.h' 2023-10-17T18:29:18,180 adding 'moleculekit/xtc_utils/include/xtc.h' 2023-10-17T18:29:18,187 adding 'moleculekit/xtc_utils/src/xdrfile.cpp' 2023-10-17T18:29:18,189 adding 'moleculekit/xtc_utils/src/xdrfile_xtc.cpp' 2023-10-17T18:29:18,191 adding 'moleculekit/xtc_utils/src/xtc.cpp' 2023-10-17T18:29:18,194 adding 'moleculekit-1.8.3.dist-info/LICENSE' 2023-10-17T18:29:18,195 adding 'moleculekit-1.8.3.dist-info/METADATA' 2023-10-17T18:29:18,196 adding 'moleculekit-1.8.3.dist-info/WHEEL' 2023-10-17T18:29:18,197 adding 'moleculekit-1.8.3.dist-info/top_level.txt' 2023-10-17T18:29:18,202 adding 'moleculekit-1.8.3.dist-info/RECORD' 2023-10-17T18:29:18,356 removing build/bdist.linux-armv7l/wheel 2023-10-17T18:29:18,622 Building wheel for moleculekit (pyproject.toml): finished with status 'done' 2023-10-17T18:29:18,951 Created wheel for moleculekit: filename=moleculekit-1.8.3-cp39-cp39-linux_armv7l.whl size=12562417 sha256=569a4d257b3bc966f3beab4da38afd0204cdb97732b075871cabcd4119443008 2023-10-17T18:29:18,952 Stored in directory: /tmp/pip-ephem-wheel-cache-ki4j991m/wheels/3f/e9/ae/0849a8831651a5ad7b60a04737803f6a69ab3f977171d3c5a5 2023-10-17T18:29:18,980 Successfully built moleculekit 2023-10-17T18:29:19,298 Removed build tracker: '/tmp/pip-build-tracker-c2as3i3r'