2024-06-05T13:49:51,682 Created temporary directory: /tmp/pip-build-tracker-d0e702au 2024-06-05T13:49:51,683 Initialized build tracking at /tmp/pip-build-tracker-d0e702au 2024-06-05T13:49:51,683 Created build tracker: /tmp/pip-build-tracker-d0e702au 2024-06-05T13:49:51,684 Entered build tracker: /tmp/pip-build-tracker-d0e702au 2024-06-05T13:49:51,684 Created temporary directory: /tmp/pip-wheel-_se2_ibc 2024-06-05T13:49:51,687 Created temporary directory: /tmp/pip-ephem-wheel-cache-to5xrh2r 2024-06-05T13:49:51,711 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-06-05T13:49:51,715 2 location(s) to search for versions of moleculekit: 2024-06-05T13:49:51,715 * https://pypi.org/simple/moleculekit/ 2024-06-05T13:49:51,715 * https://www.piwheels.org/simple/moleculekit/ 2024-06-05T13:49:51,715 Fetching project page and analyzing links: https://pypi.org/simple/moleculekit/ 2024-06-05T13:49:51,716 Getting page https://pypi.org/simple/moleculekit/ 2024-06-05T13:49:51,718 Found index url https://pypi.org/simple/ 2024-06-05T13:49:51,952 Fetched page https://pypi.org/simple/moleculekit/ as application/vnd.pypi.simple.v1+json 2024-06-05T13:49:51,994 Skipping link: No binaries permitted for moleculekit: https://files.pythonhosted.org/packages/91/e6/25b6853357dfef8a4026325e420d8213d34c17c078a2f13b60cbb6213ea3/moleculekit-0.1.4-py3-none-any.whl (from https://pypi.org/simple/moleculekit/) 2024-06-05T13:49:51,995 Found link https://files.pythonhosted.org/packages/13/0f/a200e8e7632d3a521cfc7c15fa4d0270802efce40f98ac5a5cae58385b7e/moleculekit-0.1.4.tar.gz (from https://pypi.org/simple/moleculekit/), version: 0.1.4 2024-06-05T13:49:51,995 Skipping link: No binaries permitted for moleculekit: https://files.pythonhosted.org/packages/9f/a5/eac32fcb2e9ff0d30298aa4cec8e152c95d675c4dd1a1a5d7676986d4d75/moleculekit-0.1.5-py3-none-any.whl (from https://pypi.org/simple/moleculekit/) 2024-06-05T13:49:51,996 Found link 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(from https://www.piwheels.org/simple/moleculekit/) 2024-06-05T13:49:52,648 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/) 2024-06-05T13:49:52,648 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/) 2024-06-05T13:49:52,649 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/) 2024-06-05T13:49:52,650 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/) 2024-06-05T13:49:52,650 Skipping link: not a file: https://www.piwheels.org/simple/moleculekit/ 2024-06-05T13:49:52,651 Skipping link: not a file: https://pypi.org/simple/moleculekit/ 2024-06-05T13:49:52,693 Given no hashes to check 1 links for project 'moleculekit': discarding no candidates 2024-06-05T13:49:52,714 Collecting moleculekit==1.8.33 2024-06-05T13:49:52,716 Created temporary directory: /tmp/pip-unpack-ecd9nsyi 2024-06-05T13:49:52,951 Downloading moleculekit-1.8.33.tar.gz (6.8 MB) 2024-06-05T13:49:55,707 Added moleculekit==1.8.33 from https://files.pythonhosted.org/packages/2b/34/e2642fe6f54ec67fdba107eb29968217af52f0b6ef1ac69f533164c6584e/moleculekit-1.8.33.tar.gz to build tracker '/tmp/pip-build-tracker-d0e702au' 2024-06-05T13:49:55,716 Created temporary directory: /tmp/pip-build-env-cpcib7j5 2024-06-05T13:49:55,720 Installing build dependencies: started 2024-06-05T13:49:55,721 Running command pip subprocess to install build dependencies 2024-06-05T13:49:56,853 Using pip 24.0 from /home/piwheels/.local/lib/python3.11/site-packages/pip (python 3.11) 2024-06-05T13:49:57,364 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-06-05T13:49:58,885 Collecting setuptools 2024-06-05T13:49:58,900 Using cached https://www.piwheels.org/simple/setuptools/setuptools-70.0.0-py3-none-any.whl (863 kB) 2024-06-05T13:49:59,563 Link requires a different Python (3.11.2 not in: '>=3.7,<3.11'): https://files.pythonhosted.org/packages/3a/be/650f9c091ef71cb01d735775d554e068752d3ff63d7943b26316dc401749/numpy-1.21.2.zip (from https://pypi.org/simple/numpy/) (requires-python:>=3.7,<3.11) 2024-06-05T13:49:59,567 Link requires a different Python (3.11.2 not in: '>=3.7,<3.11'): https://files.pythonhosted.org/packages/5f/d6/ad58ded26556eaeaa8c971e08b6466f17c4ac4d786cd3d800e26ce59cc01/numpy-1.21.3.zip (from https://pypi.org/simple/numpy/) (requires-python:>=3.7,<3.11) 2024-06-05T13:49:59,570 Link requires a different Python (3.11.2 not in: '>=3.7,<3.11'): https://files.pythonhosted.org/packages/fb/48/b0708ebd7718a8933f0d3937513ef8ef2f4f04529f1f66ca86d873043921/numpy-1.21.4.zip (from https://pypi.org/simple/numpy/) (requires-python:>=3.7,<3.11) 2024-06-05T13:49:59,573 Link requires a different Python (3.11.2 not in: '>=3.7,<3.11'): https://files.pythonhosted.org/packages/c2/a8/a924a09492bdfee8c2ec3094d0a13f2799800b4fdc9c890738aeeb12c72e/numpy-1.21.5.zip (from https://pypi.org/simple/numpy/) (requires-python:>=3.7,<3.11) 2024-06-05T13:49:59,576 Link requires a different Python (3.11.2 not in: '>=3.7,<3.11'): https://files.pythonhosted.org/packages/45/b7/de7b8e67f2232c26af57c205aaad29fe17754f793404f59c8a730c7a191a/numpy-1.21.6.zip (from https://pypi.org/simple/numpy/) (requires-python:>=3.7,<3.11) 2024-06-05T13:49:59,866 Collecting numpy>=1.18.5 2024-06-05T13:49:59,881 Using cached https://www.piwheels.org/simple/numpy/numpy-1.26.4-cp311-cp311-linux_armv7l.whl (5.6 MB) 2024-06-05T13:50:01,355 Collecting Cython>=0.29.21 2024-06-05T13:50:01,369 Using cached https://www.piwheels.org/simple/cython/Cython-3.0.10-cp311-cp311-linux_armv7l.whl (11.8 MB) 2024-06-05T13:50:01,771 Collecting toml 2024-06-05T13:50:01,790 Using cached https://www.piwheels.org/simple/toml/toml-0.10.2-py2.py3-none-any.whl (16 kB) 2024-06-05T13:50:01,979 Collecting versioneer==0.28 (from versioneer[toml]==0.28) 2024-06-05T13:50:01,996 Using cached https://www.piwheels.org/simple/versioneer/versioneer-0.28-py3-none-any.whl (45 kB) 2024-06-05T13:50:04,726 Installing collected packages: versioneer, toml, setuptools, numpy, Cython 2024-06-05T13:50:04,756 Creating /tmp/pip-build-env-cpcib7j5/overlay/local/bin 2024-06-05T13:50:04,758 changing mode of /tmp/pip-build-env-cpcib7j5/overlay/local/bin/versioneer to 755 2024-06-05T13:50:15,374 changing mode of /tmp/pip-build-env-cpcib7j5/overlay/local/bin/f2py to 755 2024-06-05T13:50:19,029 changing mode of /tmp/pip-build-env-cpcib7j5/overlay/local/bin/cygdb to 755 2024-06-05T13:50:19,031 changing mode of /tmp/pip-build-env-cpcib7j5/overlay/local/bin/cython to 755 2024-06-05T13:50:19,033 changing mode of /tmp/pip-build-env-cpcib7j5/overlay/local/bin/cythonize to 755 2024-06-05T13:50:19,077 Successfully installed Cython-3.0.10 numpy-1.26.4 setuptools-70.0.0 toml-0.10.2 versioneer-0.28 2024-06-05T13:50:19,743 Installing build dependencies: finished with status 'done' 2024-06-05T13:50:19,746 Getting requirements to build wheel: started 2024-06-05T13:50:19,747 Running command Getting requirements to build wheel 2024-06-05T13:50:55,253 warning: moleculekit/wrapping/wrapping.pyx:47:4: Unreachable code 2024-06-05T13:51:03,606 Compiling moleculekit/interactions/hbonds/hbonds.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,607 Compiling moleculekit/interactions/pipi/pipi.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,608 Compiling moleculekit/interactions/cationpi/cationpi.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,609 Compiling moleculekit/interactions/sigmahole/sigmahole.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,609 Compiling moleculekit/wrapping/wrapping.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,610 Compiling moleculekit/bondguesser_utils/bondguesser_utils.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,610 Compiling moleculekit/atomselect_utils/atomselect_utils.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,611 Compiling moleculekit/distance_utils/distance_utils.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,612 Compiling moleculekit/occupancy_utils/occupancy_utils.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,612 Compiling moleculekit/cython_utils/cython_utils.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,613 Compiling moleculekit/fileformats/xtc/xtc.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-06-05T13:51:03,613 Compiling moleculekit/fileformats/xtc/trr.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-06-05T13:51:03,614 Compiling moleculekit/fileformats/dcd/dcd.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-06-05T13:51:03,614 Compiling moleculekit/fileformats/binpos/binpos.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-06-05T13:51:03,615 Compiling moleculekit/tmalign/tmalign_util.pyx because it depends on /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-06-05T13:51:03,615 [ 1/15] Cythonizing moleculekit/atomselect_utils/atomselect_utils.pyx 2024-06-05T13:51:03,616 [ 2/15] Cythonizing moleculekit/bondguesser_utils/bondguesser_utils.pyx 2024-06-05T13:51:03,616 [ 3/15] Cythonizing moleculekit/cython_utils/cython_utils.pyx 2024-06-05T13:51:03,617 [ 4/15] Cythonizing moleculekit/distance_utils/distance_utils.pyx 2024-06-05T13:51:03,617 [ 5/15] Cythonizing moleculekit/fileformats/dcd/dcd.pyx 2024-06-05T13:51:03,618 [ 6/15] Cythonizing moleculekit/interactions/cationpi/cationpi.pyx 2024-06-05T13:51:03,619 [ 7/15] Cythonizing moleculekit/interactions/hbonds/hbonds.pyx 2024-06-05T13:51:03,619 [ 8/15] Cythonizing moleculekit/interactions/pipi/pipi.pyx 2024-06-05T13:51:03,620 [ 9/15] Cythonizing moleculekit/interactions/sigmahole/sigmahole.pyx 2024-06-05T13:51:03,621 [10/15] Cythonizing moleculekit/occupancy_utils/occupancy_utils.pyx 2024-06-05T13:51:03,622 [11/15] Cythonizing moleculekit/tmalign/tmalign_util.pyx 2024-06-05T13:51:03,622 [12/15] Cythonizing moleculekit/wrapping/wrapping.pyx 2024-06-05T13:51:03,623 [13/15] Cythonizing moleculekit/fileformats/binpos/binpos.pyx 2024-06-05T13:51:03,623 [14/15] Cythonizing moleculekit/fileformats/xtc/trr.pyx 2024-06-05T13:51:03,624 [15/15] Cythonizing moleculekit/fileformats/xtc/xtc.pyx 2024-06-05T13:51:03,892 running egg_info 2024-06-05T13:51:03,898 writing moleculekit.egg-info/PKG-INFO 2024-06-05T13:51:03,902 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-06-05T13:51:03,904 writing requirements to moleculekit.egg-info/requires.txt 2024-06-05T13:51:03,906 writing top-level names to moleculekit.egg-info/top_level.txt 2024-06-05T13:51:03,939 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 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2024-06-05T13:51:04,287 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-06-05T13:51:05,959 Getting requirements to build wheel: finished with status 'done' 2024-06-05T13:51:05,972 Installing backend dependencies: started 2024-06-05T13:51:05,973 Running command pip subprocess to install backend dependencies 2024-06-05T13:51:07,206 Using pip 24.0 from /home/piwheels/.local/lib/python3.11/site-packages/pip (python 3.11) 2024-06-05T13:51:07,761 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-06-05T13:51:08,298 Collecting wheel 2024-06-05T13:51:08,313 Using cached https://www.piwheels.org/simple/wheel/wheel-0.43.0-py3-none-any.whl (65 kB) 2024-06-05T13:51:10,710 Installing collected packages: wheel 2024-06-05T13:51:10,939 Creating /tmp/pip-build-env-cpcib7j5/normal/local/bin 2024-06-05T13:51:10,941 changing mode of /tmp/pip-build-env-cpcib7j5/normal/local/bin/wheel to 755 2024-06-05T13:51:10,953 Successfully installed wheel-0.43.0 2024-06-05T13:51:11,396 Installing backend dependencies: finished with status 'done' 2024-06-05T13:51:11,398 Created temporary directory: /tmp/pip-modern-metadata-ufe3sqzp 2024-06-05T13:51:11,400 Preparing metadata (pyproject.toml): started 2024-06-05T13:51:11,402 Running command Preparing metadata (pyproject.toml) 2024-06-05T13:51:13,820 running dist_info 2024-06-05T13:51:13,822 creating /tmp/pip-modern-metadata-ufe3sqzp/moleculekit.egg-info 2024-06-05T13:51:13,827 writing /tmp/pip-modern-metadata-ufe3sqzp/moleculekit.egg-info/PKG-INFO 2024-06-05T13:51:13,831 writing dependency_links to /tmp/pip-modern-metadata-ufe3sqzp/moleculekit.egg-info/dependency_links.txt 2024-06-05T13:51:13,833 writing requirements to /tmp/pip-modern-metadata-ufe3sqzp/moleculekit.egg-info/requires.txt 2024-06-05T13:51:13,835 writing top-level names to /tmp/pip-modern-metadata-ufe3sqzp/moleculekit.egg-info/top_level.txt 2024-06-05T13:51:13,836 writing manifest file 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be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,899 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,899 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,900 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,900 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,901 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,902 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,902 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,903 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,903 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,904 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,904 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,905 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:13,911 reading manifest file '/tmp/pip-modern-metadata-ufe3sqzp/moleculekit.egg-info/SOURCES.txt' 2024-06-05T13:51:13,913 reading manifest template 'MANIFEST.in' 2024-06-05T13:51:14,168 no previously-included directories found matching 'moleculekit/test-data' 2024-06-05T13:51:14,169 no previously-included directories found matching 'moleculekit/tests' 2024-06-05T13:51:14,170 no previously-included directories found matching 'package' 2024-06-05T13:51:14,171 adding license file 'LICENSE' 2024-06-05T13:51:14,183 writing manifest file '/tmp/pip-modern-metadata-ufe3sqzp/moleculekit.egg-info/SOURCES.txt' 2024-06-05T13:51:14,191 creating '/tmp/pip-modern-metadata-ufe3sqzp/moleculekit-1.8.33.dist-info' 2024-06-05T13:51:14,426 Preparing metadata (pyproject.toml): finished with status 'done' 2024-06-05T13:51:14,431 Source in /tmp/pip-wheel-_se2_ibc/moleculekit_0bff60b7c9794a6681f9a279ed9ab3ae has version 1.8.33, which satisfies requirement moleculekit==1.8.33 from https://files.pythonhosted.org/packages/2b/34/e2642fe6f54ec67fdba107eb29968217af52f0b6ef1ac69f533164c6584e/moleculekit-1.8.33.tar.gz 2024-06-05T13:51:14,432 Removed moleculekit==1.8.33 from https://files.pythonhosted.org/packages/2b/34/e2642fe6f54ec67fdba107eb29968217af52f0b6ef1ac69f533164c6584e/moleculekit-1.8.33.tar.gz from build tracker '/tmp/pip-build-tracker-d0e702au' 2024-06-05T13:51:14,437 Created temporary directory: /tmp/pip-unpack-vv4xih11 2024-06-05T13:51:14,438 Created temporary directory: /tmp/pip-unpack-ufi0immj 2024-06-05T13:51:14,446 Building wheels for collected packages: moleculekit 2024-06-05T13:51:14,450 Created temporary directory: /tmp/pip-wheel-migdce33 2024-06-05T13:51:14,450 Destination directory: /tmp/pip-wheel-migdce33 2024-06-05T13:51:14,452 Building wheel for moleculekit (pyproject.toml): started 2024-06-05T13:51:14,453 Running command Building wheel for moleculekit (pyproject.toml) 2024-06-05T13:51:16,689 running bdist_wheel 2024-06-05T13:51:16,703 running build 2024-06-05T13:51:16,704 running build_py 2024-06-05T13:51:16,711 creating build 2024-06-05T13:51:16,711 creating build/lib.linux-armv7l-cpython-311 2024-06-05T13:51:16,712 creating build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,713 copying moleculekit/version.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,715 copying moleculekit/config.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,717 copying moleculekit/opm.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,719 copying moleculekit/readers.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,723 copying moleculekit/pymolgraphics.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,725 copying moleculekit/home.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,726 copying moleculekit/viewer.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,728 copying moleculekit/_version.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,730 copying moleculekit/periodictable.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,732 copying moleculekit/vmdgraphics.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,738 copying moleculekit/bondguesser.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,741 copying moleculekit/molecule.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,745 copying moleculekit/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,747 copying moleculekit/distance.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,749 copying moleculekit/rdkitintegration.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,751 copying moleculekit/dihedral.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,753 copying moleculekit/util.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,756 copying moleculekit/align.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,758 copying moleculekit/writers.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,761 copying moleculekit/vmdviewer.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,764 copying moleculekit/rcsb.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:16,766 creating build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-06-05T13:51:16,767 copying moleculekit/atomselect/analyze.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-06-05T13:51:16,770 copying moleculekit/atomselect/languageparser.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-06-05T13:51:16,775 copying moleculekit/atomselect/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-06-05T13:51:16,777 copying moleculekit/atomselect/atomselect.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-06-05T13:51:16,780 creating build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-06-05T13:51:16,781 copying moleculekit/ply/yacc.py -> build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-06-05T13:51:16,785 copying moleculekit/ply/lex.py -> build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-06-05T13:51:16,788 copying moleculekit/ply/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-06-05T13:51:16,791 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx 2024-06-05T13:51:16,792 copying moleculekit/pdbx/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx 2024-06-05T13:51:16,795 creating build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,796 copying moleculekit/projections/metricplumed2.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,799 copying moleculekit/projections/metricrmsd.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,801 copying moleculekit/projections/metriccoordinate.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,804 copying moleculekit/projections/metricsphericalcoordinate.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,806 copying moleculekit/projections/metricfluctuation.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,809 copying moleculekit/projections/metricdihedral.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,812 copying moleculekit/projections/metricdistance.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,815 copying moleculekit/projections/metricsasa.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,817 copying moleculekit/projections/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,820 copying moleculekit/projections/metrictmscore.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,822 copying moleculekit/projections/metricgyration.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,824 copying moleculekit/projections/util.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,827 copying moleculekit/projections/metricshell.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,829 copying moleculekit/projections/projection.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,831 copying moleculekit/projections/metricsecondarystructure.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-06-05T13:51:16,835 creating build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,836 copying moleculekit/tools/docking.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,839 copying moleculekit/tools/moleculechecks.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,841 copying moleculekit/tools/modelling.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,843 copying moleculekit/tools/sequencestructuralalignment.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,846 copying moleculekit/tools/detect.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,849 copying moleculekit/tools/autosegment.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,851 copying moleculekit/tools/atomtyper.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,854 copying moleculekit/tools/hhblitsprofile.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,856 copying moleculekit/tools/voxeldescriptors.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,859 copying moleculekit/tools/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,861 copying moleculekit/tools/graphalignment.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,863 copying moleculekit/tools/crystalpacking.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,866 copying moleculekit/tools/preparation.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,869 copying moleculekit/tools/preparation_customres.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-06-05T13:51:16,872 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions 2024-06-05T13:51:16,873 copying moleculekit/interactions/interactions.py -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions 2024-06-05T13:51:16,876 copying moleculekit/interactions/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions 2024-06-05T13:51:16,878 creating build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-06-05T13:51:16,879 copying moleculekit/smallmol/smallmollib.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-06-05T13:51:16,881 copying moleculekit/smallmol/test_smallmol.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-06-05T13:51:16,883 copying moleculekit/smallmol/smallmolcdp.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-06-05T13:51:16,886 copying moleculekit/smallmol/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-06-05T13:51:16,887 copying moleculekit/smallmol/test_smallmollib.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-06-05T13:51:16,889 copying moleculekit/smallmol/util.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-06-05T13:51:16,892 copying moleculekit/smallmol/smallmol.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-06-05T13:51:16,895 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-06-05T13:51:16,896 copying moleculekit/fileformats/utils.py -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-06-05T13:51:16,899 copying moleculekit/fileformats/netcdf.py -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-06-05T13:51:16,901 copying moleculekit/fileformats/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-06-05T13:51:16,903 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-06-05T13:51:16,904 copying moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-06-05T13:51:16,907 copying moleculekit/pdbx/tests/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-06-05T13:51:16,908 copying moleculekit/pdbx/tests/PdbxWriterTests.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-06-05T13:51:16,910 copying moleculekit/pdbx/tests/PdbxReaderTests.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-06-05T13:51:16,913 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer 2024-06-05T13:51:16,913 copying moleculekit/pdbx/writer/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer 2024-06-05T13:51:16,915 copying moleculekit/pdbx/writer/PdbxWriter.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer 2024-06-05T13:51:16,918 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-06-05T13:51:16,919 copying moleculekit/pdbx/reader/PdbxParser.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-06-05T13:51:16,921 copying moleculekit/pdbx/reader/PdbxReader.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-06-05T13:51:16,923 copying moleculekit/pdbx/reader/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-06-05T13:51:16,925 copying moleculekit/pdbx/reader/PdbxContainers.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-06-05T13:51:16,928 creating build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools 2024-06-05T13:51:16,928 copying moleculekit/tools/obabel_tools/obabel_cli.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools 2024-06-05T13:51:16,930 copying moleculekit/tools/obabel_tools/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools 2024-06-05T13:51:16,933 creating build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-06-05T13:51:16,933 copying moleculekit/smallmol/tools/clustering.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-06-05T13:51:16,936 copying moleculekit/smallmol/tools/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-06-05T13:51:16,937 copying moleculekit/smallmol/tools/test_tools.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-06-05T13:51:16,939 copying moleculekit/smallmol/tools/restrainedembed.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-06-05T13:51:16,941 running egg_info 2024-06-05T13:51:16,946 writing moleculekit.egg-info/PKG-INFO 2024-06-05T13:51:16,949 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-06-05T13:51:16,951 writing requirements to moleculekit.egg-info/requires.txt 2024-06-05T13:51:16,952 writing top-level names to moleculekit.egg-info/top_level.txt 2024-06-05T13:51:16,968 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,969 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,969 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,970 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,970 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,971 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,971 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,972 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,972 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,973 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,974 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,974 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,975 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,975 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,976 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,976 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,977 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,977 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,978 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,978 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,979 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,980 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,980 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,981 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,981 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,982 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,982 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,983 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,984 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,984 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,985 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,985 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,986 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,986 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,987 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,987 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,988 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,988 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,989 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,990 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,990 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,991 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,991 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,992 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,992 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,993 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,994 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,994 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,994 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,995 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,995 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,995 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,996 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,996 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,997 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,997 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,998 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,998 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,999 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:16,999 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,000 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,000 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,001 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,002 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,002 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,003 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,003 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,004 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,004 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,005 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,005 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,005 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,006 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,007 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,007 dependency /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-06-05T13:51:17,008 reading manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-06-05T13:51:17,008 reading manifest template 'MANIFEST.in' 2024-06-05T13:51:17,236 no previously-included directories found matching 'moleculekit/test-data' 2024-06-05T13:51:17,238 no previously-included directories found matching 'moleculekit/tests' 2024-06-05T13:51:17,239 no previously-included directories found matching 'package' 2024-06-05T13:51:17,240 adding license file 'LICENSE' 2024-06-05T13:51:17,262 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-06-05T13:51:17,274 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.atomselect_utils' is absent from the `packages` configuration. 2024-06-05T13:51:17,275 !! 2024-06-05T13:51:17,276 ******************************************************************************** 2024-06-05T13:51:17,277 ############################ 2024-06-05T13:51:17,278 # Package would be ignored # 2024-06-05T13:51:17,279 ############################ 2024-06-05T13:51:17,280 Python recognizes 'moleculekit.atomselect_utils' as an importable package[^1], 2024-06-05T13:51:17,280 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,282 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,283 package, please make sure that 'moleculekit.atomselect_utils' is explicitly added 2024-06-05T13:51:17,283 to the `packages` configuration field. 2024-06-05T13:51:17,285 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,285 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,286 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,287 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,288 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,289 If you don't want 'moleculekit.atomselect_utils' to be distributed and are 2024-06-05T13:51:17,290 already explicitly excluding 'moleculekit.atomselect_utils' via 2024-06-05T13:51:17,290 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,291 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,291 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,292 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,293 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,294 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,295 even if it does not contain any `.py` files. 2024-06-05T13:51:17,295 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,296 directory, all directories are treated like packages. 2024-06-05T13:51:17,296 ******************************************************************************** 2024-06-05T13:51:17,297 !! 2024-06-05T13:51:17,298 check.warn(importable) 2024-06-05T13:51:17,298 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.bondguesser_utils' is absent from the `packages` configuration. 2024-06-05T13:51:17,299 !! 2024-06-05T13:51:17,300 ******************************************************************************** 2024-06-05T13:51:17,301 ############################ 2024-06-05T13:51:17,302 # Package would be ignored # 2024-06-05T13:51:17,302 ############################ 2024-06-05T13:51:17,303 Python recognizes 'moleculekit.bondguesser_utils' as an importable package[^1], 2024-06-05T13:51:17,304 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,305 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,306 package, please make sure that 'moleculekit.bondguesser_utils' is explicitly added 2024-06-05T13:51:17,306 to the `packages` configuration field. 2024-06-05T13:51:17,307 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,308 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,309 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,310 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,311 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,312 If you don't want 'moleculekit.bondguesser_utils' to be distributed and are 2024-06-05T13:51:17,313 already explicitly excluding 'moleculekit.bondguesser_utils' via 2024-06-05T13:51:17,313 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,314 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,314 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,316 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,317 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,318 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,319 even if it does not contain any `.py` files. 2024-06-05T13:51:17,319 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,320 directory, all directories are treated like packages. 2024-06-05T13:51:17,320 ******************************************************************************** 2024-06-05T13:51:17,321 !! 2024-06-05T13:51:17,321 check.warn(importable) 2024-06-05T13:51:17,322 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.cython_utils' is absent from the `packages` configuration. 2024-06-05T13:51:17,322 !! 2024-06-05T13:51:17,323 ******************************************************************************** 2024-06-05T13:51:17,324 ############################ 2024-06-05T13:51:17,324 # Package would be ignored # 2024-06-05T13:51:17,325 ############################ 2024-06-05T13:51:17,325 Python recognizes 'moleculekit.cython_utils' as an importable package[^1], 2024-06-05T13:51:17,326 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,326 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,327 package, please make sure that 'moleculekit.cython_utils' is explicitly added 2024-06-05T13:51:17,328 to the `packages` configuration field. 2024-06-05T13:51:17,329 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,330 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,330 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,332 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,333 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,334 If you don't want 'moleculekit.cython_utils' to be distributed and are 2024-06-05T13:51:17,335 already explicitly excluding 'moleculekit.cython_utils' via 2024-06-05T13:51:17,336 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,336 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,337 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,338 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,339 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,341 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,342 even if it does not contain any `.py` files. 2024-06-05T13:51:17,342 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,343 directory, all directories are treated like packages. 2024-06-05T13:51:17,343 ******************************************************************************** 2024-06-05T13:51:17,345 !! 2024-06-05T13:51:17,345 check.warn(importable) 2024-06-05T13:51:17,346 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.distance_utils' is absent from the `packages` configuration. 2024-06-05T13:51:17,347 !! 2024-06-05T13:51:17,348 ******************************************************************************** 2024-06-05T13:51:17,349 ############################ 2024-06-05T13:51:17,349 # Package would be ignored # 2024-06-05T13:51:17,350 ############################ 2024-06-05T13:51:17,351 Python recognizes 'moleculekit.distance_utils' as an importable package[^1], 2024-06-05T13:51:17,351 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,352 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,352 package, please make sure that 'moleculekit.distance_utils' is explicitly added 2024-06-05T13:51:17,353 to the `packages` configuration field. 2024-06-05T13:51:17,353 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,354 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,354 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,355 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,356 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,357 If you don't want 'moleculekit.distance_utils' to be distributed and are 2024-06-05T13:51:17,357 already explicitly excluding 'moleculekit.distance_utils' via 2024-06-05T13:51:17,358 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,358 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,359 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,360 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,361 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,363 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,363 even if it does not contain any `.py` files. 2024-06-05T13:51:17,364 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,365 directory, all directories are treated like packages. 2024-06-05T13:51:17,365 ******************************************************************************** 2024-06-05T13:51:17,367 !! 2024-06-05T13:51:17,367 check.warn(importable) 2024-06-05T13:51:17,368 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos' is absent from the `packages` configuration. 2024-06-05T13:51:17,368 !! 2024-06-05T13:51:17,370 ******************************************************************************** 2024-06-05T13:51:17,370 ############################ 2024-06-05T13:51:17,371 # Package would be ignored # 2024-06-05T13:51:17,372 ############################ 2024-06-05T13:51:17,372 Python recognizes 'moleculekit.fileformats.binpos' as an importable package[^1], 2024-06-05T13:51:17,373 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,374 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,374 package, please make sure that 'moleculekit.fileformats.binpos' is explicitly added 2024-06-05T13:51:17,375 to the `packages` configuration field. 2024-06-05T13:51:17,376 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,376 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,377 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,379 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,380 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,381 If you don't want 'moleculekit.fileformats.binpos' to be distributed and are 2024-06-05T13:51:17,382 already explicitly excluding 'moleculekit.fileformats.binpos' via 2024-06-05T13:51:17,383 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,383 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,384 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,385 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,385 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,387 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,387 even if it does not contain any `.py` files. 2024-06-05T13:51:17,388 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,388 directory, all directories are treated like packages. 2024-06-05T13:51:17,389 ******************************************************************************** 2024-06-05T13:51:17,390 !! 2024-06-05T13:51:17,390 check.warn(importable) 2024-06-05T13:51:17,391 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos.include' is absent from the `packages` configuration. 2024-06-05T13:51:17,391 !! 2024-06-05T13:51:17,392 ******************************************************************************** 2024-06-05T13:51:17,393 ############################ 2024-06-05T13:51:17,393 # Package would be ignored # 2024-06-05T13:51:17,394 ############################ 2024-06-05T13:51:17,395 Python recognizes 'moleculekit.fileformats.binpos.include' as an importable package[^1], 2024-06-05T13:51:17,396 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,397 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,398 package, please make sure that 'moleculekit.fileformats.binpos.include' is explicitly added 2024-06-05T13:51:17,398 to the `packages` configuration field. 2024-06-05T13:51:17,400 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,401 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,401 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,403 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,404 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,405 If you don't want 'moleculekit.fileformats.binpos.include' to be distributed and are 2024-06-05T13:51:17,406 already explicitly excluding 'moleculekit.fileformats.binpos.include' via 2024-06-05T13:51:17,406 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,407 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,408 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,409 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,410 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,412 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,413 even if it does not contain any `.py` files. 2024-06-05T13:51:17,413 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,414 directory, all directories are treated like packages. 2024-06-05T13:51:17,415 ******************************************************************************** 2024-06-05T13:51:17,416 !! 2024-06-05T13:51:17,417 check.warn(importable) 2024-06-05T13:51:17,417 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos.src' is absent from the `packages` configuration. 2024-06-05T13:51:17,418 !! 2024-06-05T13:51:17,419 ******************************************************************************** 2024-06-05T13:51:17,419 ############################ 2024-06-05T13:51:17,419 # Package would be ignored # 2024-06-05T13:51:17,420 ############################ 2024-06-05T13:51:17,420 Python recognizes 'moleculekit.fileformats.binpos.src' as an importable package[^1], 2024-06-05T13:51:17,421 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,422 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,422 package, please make sure that 'moleculekit.fileformats.binpos.src' is explicitly added 2024-06-05T13:51:17,423 to the `packages` configuration field. 2024-06-05T13:51:17,424 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,424 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,424 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,425 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,426 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,428 If you don't want 'moleculekit.fileformats.binpos.src' to be distributed and are 2024-06-05T13:51:17,428 already explicitly excluding 'moleculekit.fileformats.binpos.src' via 2024-06-05T13:51:17,429 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,430 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,430 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,432 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,433 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,435 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,436 even if it does not contain any `.py` files. 2024-06-05T13:51:17,437 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,437 directory, all directories are treated like packages. 2024-06-05T13:51:17,438 ******************************************************************************** 2024-06-05T13:51:17,439 !! 2024-06-05T13:51:17,440 check.warn(importable) 2024-06-05T13:51:17,440 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd' is absent from the `packages` configuration. 2024-06-05T13:51:17,441 !! 2024-06-05T13:51:17,442 ******************************************************************************** 2024-06-05T13:51:17,443 ############################ 2024-06-05T13:51:17,443 # Package would be ignored # 2024-06-05T13:51:17,444 ############################ 2024-06-05T13:51:17,445 Python recognizes 'moleculekit.fileformats.dcd' as an importable package[^1], 2024-06-05T13:51:17,445 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,447 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,447 package, please make sure that 'moleculekit.fileformats.dcd' is explicitly added 2024-06-05T13:51:17,448 to the `packages` configuration field. 2024-06-05T13:51:17,450 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,450 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,450 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,451 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,452 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,453 If you don't want 'moleculekit.fileformats.dcd' to be distributed and are 2024-06-05T13:51:17,454 already explicitly excluding 'moleculekit.fileformats.dcd' via 2024-06-05T13:51:17,454 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,454 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,455 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,456 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,457 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,458 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,459 even if it does not contain any `.py` files. 2024-06-05T13:51:17,459 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,460 directory, all directories are treated like packages. 2024-06-05T13:51:17,460 ******************************************************************************** 2024-06-05T13:51:17,461 !! 2024-06-05T13:51:17,462 check.warn(importable) 2024-06-05T13:51:17,462 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd.include' is absent from the `packages` configuration. 2024-06-05T13:51:17,463 !! 2024-06-05T13:51:17,464 ******************************************************************************** 2024-06-05T13:51:17,465 ############################ 2024-06-05T13:51:17,466 # Package would be ignored # 2024-06-05T13:51:17,466 ############################ 2024-06-05T13:51:17,467 Python recognizes 'moleculekit.fileformats.dcd.include' as an importable package[^1], 2024-06-05T13:51:17,468 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,469 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,470 package, please make sure that 'moleculekit.fileformats.dcd.include' is explicitly added 2024-06-05T13:51:17,470 to the `packages` configuration field. 2024-06-05T13:51:17,471 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,472 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,473 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,474 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,475 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,476 If you don't want 'moleculekit.fileformats.dcd.include' to be distributed and are 2024-06-05T13:51:17,477 already explicitly excluding 'moleculekit.fileformats.dcd.include' via 2024-06-05T13:51:17,477 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,478 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,479 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,480 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,482 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,483 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,483 even if it does not contain any `.py` files. 2024-06-05T13:51:17,484 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,484 directory, all directories are treated like packages. 2024-06-05T13:51:17,485 ******************************************************************************** 2024-06-05T13:51:17,486 !! 2024-06-05T13:51:17,486 check.warn(importable) 2024-06-05T13:51:17,487 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd.src' is absent from the `packages` configuration. 2024-06-05T13:51:17,487 !! 2024-06-05T13:51:17,488 ******************************************************************************** 2024-06-05T13:51:17,489 ############################ 2024-06-05T13:51:17,489 # Package would be ignored # 2024-06-05T13:51:17,490 ############################ 2024-06-05T13:51:17,490 Python recognizes 'moleculekit.fileformats.dcd.src' as an importable package[^1], 2024-06-05T13:51:17,491 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,492 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,492 package, please make sure that 'moleculekit.fileformats.dcd.src' is explicitly added 2024-06-05T13:51:17,493 to the `packages` configuration field. 2024-06-05T13:51:17,494 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,495 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,495 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,496 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,498 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,499 If you don't want 'moleculekit.fileformats.dcd.src' to be distributed and are 2024-06-05T13:51:17,500 already explicitly excluding 'moleculekit.fileformats.dcd.src' via 2024-06-05T13:51:17,500 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,501 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,502 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,503 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,505 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,506 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,507 even if it does not contain any `.py` files. 2024-06-05T13:51:17,508 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,508 directory, all directories are treated like packages. 2024-06-05T13:51:17,509 ******************************************************************************** 2024-06-05T13:51:17,510 !! 2024-06-05T13:51:17,511 check.warn(importable) 2024-06-05T13:51:17,512 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc' is absent from the `packages` configuration. 2024-06-05T13:51:17,513 !! 2024-06-05T13:51:17,514 ******************************************************************************** 2024-06-05T13:51:17,515 ############################ 2024-06-05T13:51:17,515 # Package would be ignored # 2024-06-05T13:51:17,516 ############################ 2024-06-05T13:51:17,517 Python recognizes 'moleculekit.fileformats.xtc' as an importable package[^1], 2024-06-05T13:51:17,518 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,519 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,519 package, please make sure that 'moleculekit.fileformats.xtc' is explicitly added 2024-06-05T13:51:17,520 to the `packages` configuration field. 2024-06-05T13:51:17,521 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,521 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,523 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,526 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,543 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,544 If you don't want 'moleculekit.fileformats.xtc' to be distributed and are 2024-06-05T13:51:17,544 already explicitly excluding 'moleculekit.fileformats.xtc' via 2024-06-05T13:51:17,545 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,545 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,546 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,547 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,548 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,550 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,551 even if it does not contain any `.py` files. 2024-06-05T13:51:17,552 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,552 directory, all directories are treated like packages. 2024-06-05T13:51:17,553 ******************************************************************************** 2024-06-05T13:51:17,555 !! 2024-06-05T13:51:17,555 check.warn(importable) 2024-06-05T13:51:17,556 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc.include' is absent from the `packages` configuration. 2024-06-05T13:51:17,557 !! 2024-06-05T13:51:17,558 ******************************************************************************** 2024-06-05T13:51:17,559 ############################ 2024-06-05T13:51:17,560 # Package would be ignored # 2024-06-05T13:51:17,561 ############################ 2024-06-05T13:51:17,563 Python recognizes 'moleculekit.fileformats.xtc.include' as an importable package[^1], 2024-06-05T13:51:17,564 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,568 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,570 package, please make sure that 'moleculekit.fileformats.xtc.include' is explicitly added 2024-06-05T13:51:17,573 to the `packages` configuration field. 2024-06-05T13:51:17,574 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,577 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,578 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,582 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,584 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,586 If you don't want 'moleculekit.fileformats.xtc.include' to be distributed and are 2024-06-05T13:51:17,586 already explicitly excluding 'moleculekit.fileformats.xtc.include' via 2024-06-05T13:51:17,587 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,587 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,588 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,590 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,591 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,593 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,593 even if it does not contain any `.py` files. 2024-06-05T13:51:17,594 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,594 directory, all directories are treated like packages. 2024-06-05T13:51:17,595 ******************************************************************************** 2024-06-05T13:51:17,596 !! 2024-06-05T13:51:17,597 check.warn(importable) 2024-06-05T13:51:17,600 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc.src' is absent from the `packages` configuration. 2024-06-05T13:51:17,602 !! 2024-06-05T13:51:17,605 ******************************************************************************** 2024-06-05T13:51:17,609 ############################ 2024-06-05T13:51:17,612 # Package would be ignored # 2024-06-05T13:51:17,613 ############################ 2024-06-05T13:51:17,616 Python recognizes 'moleculekit.fileformats.xtc.src' as an importable package[^1], 2024-06-05T13:51:17,616 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,618 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,619 package, please make sure that 'moleculekit.fileformats.xtc.src' is explicitly added 2024-06-05T13:51:17,620 to the `packages` configuration field. 2024-06-05T13:51:17,621 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,622 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,622 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,624 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,625 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,627 If you don't want 'moleculekit.fileformats.xtc.src' to be distributed and are 2024-06-05T13:51:17,627 already explicitly excluding 'moleculekit.fileformats.xtc.src' via 2024-06-05T13:51:17,628 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,628 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,629 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,630 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,631 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,633 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,634 even if it does not contain any `.py` files. 2024-06-05T13:51:17,634 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,635 directory, all directories are treated like packages. 2024-06-05T13:51:17,636 ******************************************************************************** 2024-06-05T13:51:17,637 !! 2024-06-05T13:51:17,637 check.warn(importable) 2024-06-05T13:51:17,638 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.cationpi' is absent from the `packages` configuration. 2024-06-05T13:51:17,639 !! 2024-06-05T13:51:17,640 ******************************************************************************** 2024-06-05T13:51:17,640 ############################ 2024-06-05T13:51:17,641 # Package would be ignored # 2024-06-05T13:51:17,641 ############################ 2024-06-05T13:51:17,642 Python recognizes 'moleculekit.interactions.cationpi' as an importable package[^1], 2024-06-05T13:51:17,643 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,644 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,644 package, please make sure that 'moleculekit.interactions.cationpi' is explicitly added 2024-06-05T13:51:17,645 to the `packages` configuration field. 2024-06-05T13:51:17,646 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,646 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,647 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,648 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,653 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,657 If you don't want 'moleculekit.interactions.cationpi' to be distributed and are 2024-06-05T13:51:17,657 already explicitly excluding 'moleculekit.interactions.cationpi' via 2024-06-05T13:51:17,658 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,658 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,659 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,660 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,661 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,663 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,664 even if it does not contain any `.py` files. 2024-06-05T13:51:17,664 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,665 directory, all directories are treated like packages. 2024-06-05T13:51:17,666 ******************************************************************************** 2024-06-05T13:51:17,667 !! 2024-06-05T13:51:17,667 check.warn(importable) 2024-06-05T13:51:17,668 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.hbonds' is absent from the `packages` configuration. 2024-06-05T13:51:17,669 !! 2024-06-05T13:51:17,680 ******************************************************************************** 2024-06-05T13:51:17,681 ############################ 2024-06-05T13:51:17,681 # Package would be ignored # 2024-06-05T13:51:17,682 ############################ 2024-06-05T13:51:17,682 Python recognizes 'moleculekit.interactions.hbonds' as an importable package[^1], 2024-06-05T13:51:17,683 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,684 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,684 package, please make sure that 'moleculekit.interactions.hbonds' is explicitly added 2024-06-05T13:51:17,685 to the `packages` configuration field. 2024-06-05T13:51:17,686 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,687 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,687 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,688 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,689 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,690 If you don't want 'moleculekit.interactions.hbonds' to be distributed and are 2024-06-05T13:51:17,690 already explicitly excluding 'moleculekit.interactions.hbonds' via 2024-06-05T13:51:17,690 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,691 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,692 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,692 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,693 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,695 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,695 even if it does not contain any `.py` files. 2024-06-05T13:51:17,696 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,696 directory, all directories are treated like packages. 2024-06-05T13:51:17,697 ******************************************************************************** 2024-06-05T13:51:17,698 !! 2024-06-05T13:51:17,699 check.warn(importable) 2024-06-05T13:51:17,699 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.pipi' is absent from the `packages` configuration. 2024-06-05T13:51:17,700 !! 2024-06-05T13:51:17,701 ******************************************************************************** 2024-06-05T13:51:17,702 ############################ 2024-06-05T13:51:17,702 # Package would be ignored # 2024-06-05T13:51:17,703 ############################ 2024-06-05T13:51:17,703 Python recognizes 'moleculekit.interactions.pipi' as an importable package[^1], 2024-06-05T13:51:17,704 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,705 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,706 package, please make sure that 'moleculekit.interactions.pipi' is explicitly added 2024-06-05T13:51:17,707 to the `packages` configuration field. 2024-06-05T13:51:17,708 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,709 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,709 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,710 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,711 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,713 If you don't want 'moleculekit.interactions.pipi' to be distributed and are 2024-06-05T13:51:17,713 already explicitly excluding 'moleculekit.interactions.pipi' via 2024-06-05T13:51:17,714 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,714 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,715 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,716 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,718 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,719 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,719 even if it does not contain any `.py` files. 2024-06-05T13:51:17,720 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,720 directory, all directories are treated like packages. 2024-06-05T13:51:17,721 ******************************************************************************** 2024-06-05T13:51:17,721 !! 2024-06-05T13:51:17,722 check.warn(importable) 2024-06-05T13:51:17,722 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.sigmahole' is absent from the `packages` configuration. 2024-06-05T13:51:17,723 !! 2024-06-05T13:51:17,724 ******************************************************************************** 2024-06-05T13:51:17,724 ############################ 2024-06-05T13:51:17,724 # Package would be ignored # 2024-06-05T13:51:17,725 ############################ 2024-06-05T13:51:17,725 Python recognizes 'moleculekit.interactions.sigmahole' as an importable package[^1], 2024-06-05T13:51:17,726 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,727 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,727 package, please make sure that 'moleculekit.interactions.sigmahole' is explicitly added 2024-06-05T13:51:17,728 to the `packages` configuration field. 2024-06-05T13:51:17,729 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,729 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,730 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,731 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,733 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,734 If you don't want 'moleculekit.interactions.sigmahole' to be distributed and are 2024-06-05T13:51:17,735 already explicitly excluding 'moleculekit.interactions.sigmahole' via 2024-06-05T13:51:17,735 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,736 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,737 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,738 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,739 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,741 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,741 even if it does not contain any `.py` files. 2024-06-05T13:51:17,742 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,742 directory, all directories are treated like packages. 2024-06-05T13:51:17,743 ******************************************************************************** 2024-06-05T13:51:17,744 !! 2024-06-05T13:51:17,745 check.warn(importable) 2024-06-05T13:51:17,745 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.occupancy_utils' is absent from the `packages` configuration. 2024-06-05T13:51:17,746 !! 2024-06-05T13:51:17,747 ******************************************************************************** 2024-06-05T13:51:17,748 ############################ 2024-06-05T13:51:17,749 # Package would be ignored # 2024-06-05T13:51:17,749 ############################ 2024-06-05T13:51:17,750 Python recognizes 'moleculekit.occupancy_utils' as an importable package[^1], 2024-06-05T13:51:17,750 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,751 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,751 package, please make sure that 'moleculekit.occupancy_utils' is explicitly added 2024-06-05T13:51:17,752 to the `packages` configuration field. 2024-06-05T13:51:17,753 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,753 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,754 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,754 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,755 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,756 If you don't want 'moleculekit.occupancy_utils' to be distributed and are 2024-06-05T13:51:17,756 already explicitly excluding 'moleculekit.occupancy_utils' via 2024-06-05T13:51:17,757 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,757 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,758 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,759 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,760 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,762 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,762 even if it does not contain any `.py` files. 2024-06-05T13:51:17,763 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,784 directory, all directories are treated like packages. 2024-06-05T13:51:17,794 ******************************************************************************** 2024-06-05T13:51:17,833 !! 2024-06-05T13:51:17,855 check.warn(importable) 2024-06-05T13:51:17,879 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share' is absent from the `packages` configuration. 2024-06-05T13:51:17,902 !! 2024-06-05T13:51:17,905 ******************************************************************************** 2024-06-05T13:51:17,905 ############################ 2024-06-05T13:51:17,906 # Package would be ignored # 2024-06-05T13:51:17,907 ############################ 2024-06-05T13:51:17,907 Python recognizes 'moleculekit.share' as an importable package[^1], 2024-06-05T13:51:17,908 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,909 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,910 package, please make sure that 'moleculekit.share' is explicitly added 2024-06-05T13:51:17,910 to the `packages` configuration field. 2024-06-05T13:51:17,911 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,912 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,913 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,914 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,915 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,916 If you don't want 'moleculekit.share' to be distributed and are 2024-06-05T13:51:17,917 already explicitly excluding 'moleculekit.share' via 2024-06-05T13:51:17,918 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,918 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,919 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,920 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,921 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,923 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,924 even if it does not contain any `.py` files. 2024-06-05T13:51:17,924 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,925 directory, all directories are treated like packages. 2024-06-05T13:51:17,925 ******************************************************************************** 2024-06-05T13:51:17,927 !! 2024-06-05T13:51:17,927 check.warn(importable) 2024-06-05T13:51:17,928 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share.atomselect' is absent from the `packages` configuration. 2024-06-05T13:51:17,928 !! 2024-06-05T13:51:17,930 ******************************************************************************** 2024-06-05T13:51:17,930 ############################ 2024-06-05T13:51:17,931 # Package would be ignored # 2024-06-05T13:51:17,931 ############################ 2024-06-05T13:51:17,932 Python recognizes 'moleculekit.share.atomselect' as an importable package[^1], 2024-06-05T13:51:17,933 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,934 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,935 package, please make sure that 'moleculekit.share.atomselect' is explicitly added 2024-06-05T13:51:17,935 to the `packages` configuration field. 2024-06-05T13:51:17,937 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,937 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,938 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,940 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,941 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,942 If you don't want 'moleculekit.share.atomselect' to be distributed and are 2024-06-05T13:51:17,943 already explicitly excluding 'moleculekit.share.atomselect' via 2024-06-05T13:51:17,944 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,944 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,945 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,947 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,948 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,950 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,951 even if it does not contain any `.py` files. 2024-06-05T13:51:17,951 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,952 directory, all directories are treated like packages. 2024-06-05T13:51:17,953 ******************************************************************************** 2024-06-05T13:51:17,954 !! 2024-06-05T13:51:17,954 check.warn(importable) 2024-06-05T13:51:17,956 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share.pdb2pqr.residues' is absent from the `packages` configuration. 2024-06-05T13:51:17,956 !! 2024-06-05T13:51:17,957 ******************************************************************************** 2024-06-05T13:51:17,958 ############################ 2024-06-05T13:51:17,958 # Package would be ignored # 2024-06-05T13:51:17,960 ############################ 2024-06-05T13:51:17,960 Python recognizes 'moleculekit.share.pdb2pqr.residues' as an importable package[^1], 2024-06-05T13:51:17,961 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,962 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,963 package, please make sure that 'moleculekit.share.pdb2pqr.residues' is explicitly added 2024-06-05T13:51:17,963 to the `packages` configuration field. 2024-06-05T13:51:17,964 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,965 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,966 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,967 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,968 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,970 If you don't want 'moleculekit.share.pdb2pqr.residues' to be distributed and are 2024-06-05T13:51:17,970 already explicitly excluding 'moleculekit.share.pdb2pqr.residues' via 2024-06-05T13:51:17,971 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,972 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,972 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:17,974 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:17,975 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:17,977 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:17,977 even if it does not contain any `.py` files. 2024-06-05T13:51:17,978 On the other hand, currently there is no concept of package data 2024-06-05T13:51:17,979 directory, all directories are treated like packages. 2024-06-05T13:51:17,979 ******************************************************************************** 2024-06-05T13:51:17,981 !! 2024-06-05T13:51:17,981 check.warn(importable) 2024-06-05T13:51:17,982 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign' is absent from the `packages` configuration. 2024-06-05T13:51:17,982 !! 2024-06-05T13:51:17,984 ******************************************************************************** 2024-06-05T13:51:17,984 ############################ 2024-06-05T13:51:17,985 # Package would be ignored # 2024-06-05T13:51:17,986 ############################ 2024-06-05T13:51:17,987 Python recognizes 'moleculekit.tmalign' as an importable package[^1], 2024-06-05T13:51:17,987 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:17,989 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:17,989 package, please make sure that 'moleculekit.tmalign' is explicitly added 2024-06-05T13:51:17,990 to the `packages` configuration field. 2024-06-05T13:51:17,991 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:17,992 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:17,993 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:17,994 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:17,995 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:17,996 If you don't want 'moleculekit.tmalign' to be distributed and are 2024-06-05T13:51:17,997 already explicitly excluding 'moleculekit.tmalign' via 2024-06-05T13:51:17,998 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:17,998 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:17,999 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:18,000 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:18,001 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:18,003 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:18,004 even if it does not contain any `.py` files. 2024-06-05T13:51:18,005 On the other hand, currently there is no concept of package data 2024-06-05T13:51:18,005 directory, all directories are treated like packages. 2024-06-05T13:51:18,006 ******************************************************************************** 2024-06-05T13:51:18,007 !! 2024-06-05T13:51:18,008 check.warn(importable) 2024-06-05T13:51:18,008 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.include' is absent from the `packages` configuration. 2024-06-05T13:51:18,009 !! 2024-06-05T13:51:18,010 ******************************************************************************** 2024-06-05T13:51:18,011 ############################ 2024-06-05T13:51:18,011 # Package would be ignored # 2024-06-05T13:51:18,012 ############################ 2024-06-05T13:51:18,013 Python recognizes 'moleculekit.tmalign.include' as an importable package[^1], 2024-06-05T13:51:18,014 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:18,015 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:18,015 package, please make sure that 'moleculekit.tmalign.include' is explicitly added 2024-06-05T13:51:18,016 to the `packages` configuration field. 2024-06-05T13:51:18,017 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:18,018 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:18,019 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:18,020 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:18,021 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:18,022 If you don't want 'moleculekit.tmalign.include' to be distributed and are 2024-06-05T13:51:18,023 already explicitly excluding 'moleculekit.tmalign.include' via 2024-06-05T13:51:18,024 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:18,025 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:18,025 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:18,027 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:18,028 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:18,030 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:18,031 even if it does not contain any `.py` files. 2024-06-05T13:51:18,032 On the other hand, currently there is no concept of package data 2024-06-05T13:51:18,033 directory, all directories are treated like packages. 2024-06-05T13:51:18,033 ******************************************************************************** 2024-06-05T13:51:18,035 !! 2024-06-05T13:51:18,035 check.warn(importable) 2024-06-05T13:51:18,036 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.src' is absent from the `packages` configuration. 2024-06-05T13:51:18,036 !! 2024-06-05T13:51:18,038 ******************************************************************************** 2024-06-05T13:51:18,039 ############################ 2024-06-05T13:51:18,039 # Package would be ignored # 2024-06-05T13:51:18,040 ############################ 2024-06-05T13:51:18,040 Python recognizes 'moleculekit.tmalign.src' as an importable package[^1], 2024-06-05T13:51:18,041 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:18,042 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:18,042 package, please make sure that 'moleculekit.tmalign.src' is explicitly added 2024-06-05T13:51:18,043 to the `packages` configuration field. 2024-06-05T13:51:18,044 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:18,045 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:18,046 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:18,047 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:18,048 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:18,050 If you don't want 'moleculekit.tmalign.src' to be distributed and are 2024-06-05T13:51:18,051 already explicitly excluding 'moleculekit.tmalign.src' via 2024-06-05T13:51:18,051 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:18,052 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:18,053 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:18,054 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:18,056 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:18,057 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:18,058 even if it does not contain any `.py` files. 2024-06-05T13:51:18,059 On the other hand, currently there is no concept of package data 2024-06-05T13:51:18,060 directory, all directories are treated like packages. 2024-06-05T13:51:18,060 ******************************************************************************** 2024-06-05T13:51:18,062 !! 2024-06-05T13:51:18,062 check.warn(importable) 2024-06-05T13:51:18,063 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.wrapping' is absent from the `packages` configuration. 2024-06-05T13:51:18,064 !! 2024-06-05T13:51:18,065 ******************************************************************************** 2024-06-05T13:51:18,066 ############################ 2024-06-05T13:51:18,067 # Package would be ignored # 2024-06-05T13:51:18,067 ############################ 2024-06-05T13:51:18,068 Python recognizes 'moleculekit.wrapping' as an importable package[^1], 2024-06-05T13:51:18,069 but it is absent from setuptools' `packages` configuration. 2024-06-05T13:51:18,070 This leads to an ambiguous overall configuration. If you want to distribute this 2024-06-05T13:51:18,071 package, please make sure that 'moleculekit.wrapping' is explicitly added 2024-06-05T13:51:18,072 to the `packages` configuration field. 2024-06-05T13:51:18,073 Alternatively, you can also rely on setuptools' discovery methods 2024-06-05T13:51:18,074 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-06-05T13:51:18,074 instead of `find_packages(...)`/`find:`). 2024-06-05T13:51:18,075 You can read more about "package discovery" on setuptools documentation page: 2024-06-05T13:51:18,077 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-06-05T13:51:18,078 If you don't want 'moleculekit.wrapping' to be distributed and are 2024-06-05T13:51:18,079 already explicitly excluding 'moleculekit.wrapping' via 2024-06-05T13:51:18,079 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-06-05T13:51:18,080 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-06-05T13:51:18,081 combination with a more fine grained `package-data` configuration. 2024-06-05T13:51:18,082 You can read more about "package data files" on setuptools documentation page: 2024-06-05T13:51:18,083 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-06-05T13:51:18,085 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-06-05T13:51:18,086 even if it does not contain any `.py` files. 2024-06-05T13:51:18,087 On the other hand, currently there is no concept of package data 2024-06-05T13:51:18,087 directory, all directories are treated like packages. 2024-06-05T13:51:18,088 ******************************************************************************** 2024-06-05T13:51:18,089 !! 2024-06-05T13:51:18,090 check.warn(importable) 2024-06-05T13:51:18,090 copying moleculekit/logging.ini -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:18,091 copying moleculekit/vmd_wrapper -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:18,092 creating build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-06-05T13:51:18,092 copying moleculekit/atomselect_utils/atomselect_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-06-05T13:51:18,093 copying moleculekit/atomselect_utils/atomselect_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-06-05T13:51:18,094 creating build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-06-05T13:51:18,095 copying moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-06-05T13:51:18,095 copying moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-06-05T13:51:18,096 creating build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-06-05T13:51:18,097 copying moleculekit/cython_utils/cython_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-06-05T13:51:18,097 copying moleculekit/cython_utils/cython_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-06-05T13:51:18,098 creating build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-06-05T13:51:18,099 copying moleculekit/distance_utils/distance_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-06-05T13:51:18,099 copying moleculekit/distance_utils/distance_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-06-05T13:51:18,100 creating build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-06-05T13:51:18,101 copying moleculekit/occupancy_utils/occupancy_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-06-05T13:51:18,102 copying moleculekit/occupancy_utils/occupancy_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-06-05T13:51:18,102 creating build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-06-05T13:51:18,103 copying moleculekit/share/ALA.cif -> build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-06-05T13:51:18,103 copying moleculekit/share/backbone.cif -> build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-06-05T13:51:18,104 copying moleculekit/share/opm_sequences.json -> build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-06-05T13:51:18,105 creating build/lib.linux-armv7l-cpython-311/moleculekit/share/atomselect 2024-06-05T13:51:18,105 copying moleculekit/share/atomselect/atomselect.json -> build/lib.linux-armv7l-cpython-311/moleculekit/share/atomselect 2024-06-05T13:51:18,106 creating build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr 2024-06-05T13:51:18,106 creating build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,107 copying moleculekit/share/pdb2pqr/residues/.gitkeep -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,108 copying moleculekit/share/pdb2pqr/residues/004.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,108 copying moleculekit/share/pdb2pqr/residues/004.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,109 copying moleculekit/share/pdb2pqr/residues/03Y.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,110 copying moleculekit/share/pdb2pqr/residues/03Y.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,110 copying moleculekit/share/pdb2pqr/residues/0A1.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,111 copying moleculekit/share/pdb2pqr/residues/0A1.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,112 copying moleculekit/share/pdb2pqr/residues/0AF.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,112 copying moleculekit/share/pdb2pqr/residues/0AF.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,113 copying moleculekit/share/pdb2pqr/residues/0BN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,113 copying moleculekit/share/pdb2pqr/residues/0BN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,114 copying moleculekit/share/pdb2pqr/residues/1MH.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,115 copying moleculekit/share/pdb2pqr/residues/1MH.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,116 copying moleculekit/share/pdb2pqr/residues/2AS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,116 copying moleculekit/share/pdb2pqr/residues/2AS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,117 copying moleculekit/share/pdb2pqr/residues/2GX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,118 copying moleculekit/share/pdb2pqr/residues/2GX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,118 copying moleculekit/share/pdb2pqr/residues/2ML.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,119 copying moleculekit/share/pdb2pqr/residues/2ML.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,120 copying moleculekit/share/pdb2pqr/residues/2MR.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,121 copying moleculekit/share/pdb2pqr/residues/2MR.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,122 copying moleculekit/share/pdb2pqr/residues/4IN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,123 copying moleculekit/share/pdb2pqr/residues/4IN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,125 copying moleculekit/share/pdb2pqr/residues/4PH.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,125 copying moleculekit/share/pdb2pqr/residues/4PH.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,126 copying moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,127 copying moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,128 copying moleculekit/share/pdb2pqr/residues/5JP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,129 copying moleculekit/share/pdb2pqr/residues/5JP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,129 copying moleculekit/share/pdb2pqr/residues/AA4.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,130 copying moleculekit/share/pdb2pqr/residues/AA4.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,132 copying moleculekit/share/pdb2pqr/residues/ABA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,132 copying moleculekit/share/pdb2pqr/residues/ABA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,133 copying moleculekit/share/pdb2pqr/residues/AHP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,133 copying moleculekit/share/pdb2pqr/residues/AHP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,134 copying moleculekit/share/pdb2pqr/residues/ALC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,134 copying moleculekit/share/pdb2pqr/residues/ALC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,135 copying moleculekit/share/pdb2pqr/residues/ALN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,136 copying moleculekit/share/pdb2pqr/residues/ALN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,137 copying moleculekit/share/pdb2pqr/residues/ALY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,137 copying moleculekit/share/pdb2pqr/residues/ALY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,138 copying moleculekit/share/pdb2pqr/residues/APD.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,139 copying moleculekit/share/pdb2pqr/residues/APD.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,140 copying moleculekit/share/pdb2pqr/residues/BB8.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,140 copying moleculekit/share/pdb2pqr/residues/BB8.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,141 copying moleculekit/share/pdb2pqr/residues/BCS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,142 copying moleculekit/share/pdb2pqr/residues/BCS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,142 copying moleculekit/share/pdb2pqr/residues/BTK.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,143 copying moleculekit/share/pdb2pqr/residues/BTK.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,144 copying moleculekit/share/pdb2pqr/residues/CCS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,145 copying moleculekit/share/pdb2pqr/residues/CCS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,146 copying moleculekit/share/pdb2pqr/residues/CGU.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,147 copying moleculekit/share/pdb2pqr/residues/CGU.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,148 copying moleculekit/share/pdb2pqr/residues/CSA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,149 copying moleculekit/share/pdb2pqr/residues/CSA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,150 copying moleculekit/share/pdb2pqr/residues/CSO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,150 copying moleculekit/share/pdb2pqr/residues/CSO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,151 copying moleculekit/share/pdb2pqr/residues/CSP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,152 copying moleculekit/share/pdb2pqr/residues/CSP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,152 copying moleculekit/share/pdb2pqr/residues/CSS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,153 copying moleculekit/share/pdb2pqr/residues/CSS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,154 copying moleculekit/share/pdb2pqr/residues/D4P.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,154 copying moleculekit/share/pdb2pqr/residues/D4P.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,155 copying moleculekit/share/pdb2pqr/residues/DA2.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,156 copying moleculekit/share/pdb2pqr/residues/DA2.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,156 copying moleculekit/share/pdb2pqr/residues/DAB.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,157 copying moleculekit/share/pdb2pqr/residues/DAB.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,158 copying moleculekit/share/pdb2pqr/residues/DAH.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,159 copying moleculekit/share/pdb2pqr/residues/DAH.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,159 copying moleculekit/share/pdb2pqr/residues/DPP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,160 copying moleculekit/share/pdb2pqr/residues/DPP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,160 copying moleculekit/share/pdb2pqr/residues/ESC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,161 copying moleculekit/share/pdb2pqr/residues/ESC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,162 copying moleculekit/share/pdb2pqr/residues/FGL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,163 copying moleculekit/share/pdb2pqr/residues/FGL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,164 copying moleculekit/share/pdb2pqr/residues/GHG.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,164 copying moleculekit/share/pdb2pqr/residues/GHG.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,165 copying moleculekit/share/pdb2pqr/residues/GME.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,166 copying moleculekit/share/pdb2pqr/residues/GME.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,166 copying moleculekit/share/pdb2pqr/residues/GNC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,167 copying moleculekit/share/pdb2pqr/residues/GNC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,168 copying moleculekit/share/pdb2pqr/residues/HHK.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,169 copying moleculekit/share/pdb2pqr/residues/HHK.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,169 copying moleculekit/share/pdb2pqr/residues/HLU.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,170 copying moleculekit/share/pdb2pqr/residues/HLU.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,171 copying moleculekit/share/pdb2pqr/residues/HLX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,171 copying moleculekit/share/pdb2pqr/residues/HLX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,172 copying moleculekit/share/pdb2pqr/residues/HOX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,172 copying moleculekit/share/pdb2pqr/residues/HOX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,173 copying moleculekit/share/pdb2pqr/residues/HPE.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,174 copying moleculekit/share/pdb2pqr/residues/HPE.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,175 copying moleculekit/share/pdb2pqr/residues/HQA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,175 copying moleculekit/share/pdb2pqr/residues/HQA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,176 copying moleculekit/share/pdb2pqr/residues/HTR.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,177 copying moleculekit/share/pdb2pqr/residues/HTR.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,177 copying moleculekit/share/pdb2pqr/residues/HYP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,178 copying moleculekit/share/pdb2pqr/residues/HYP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,180 copying moleculekit/share/pdb2pqr/residues/I2M.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,183 copying moleculekit/share/pdb2pqr/residues/I2M.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,185 copying moleculekit/share/pdb2pqr/residues/IGL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,187 copying moleculekit/share/pdb2pqr/residues/IGL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,189 copying moleculekit/share/pdb2pqr/residues/IIL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,191 copying moleculekit/share/pdb2pqr/residues/IIL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,194 copying moleculekit/share/pdb2pqr/residues/IML.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,196 copying moleculekit/share/pdb2pqr/residues/IML.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,198 copying moleculekit/share/pdb2pqr/residues/KYN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,201 copying moleculekit/share/pdb2pqr/residues/KYN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,203 copying moleculekit/share/pdb2pqr/residues/LME.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,205 copying moleculekit/share/pdb2pqr/residues/LME.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,207 copying moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,209 copying moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,212 copying moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,214 copying moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,216 copying moleculekit/share/pdb2pqr/residues/M3L.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,218 copying moleculekit/share/pdb2pqr/residues/M3L.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,221 copying moleculekit/share/pdb2pqr/residues/ME0.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,223 copying moleculekit/share/pdb2pqr/residues/ME0.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,226 copying moleculekit/share/pdb2pqr/residues/MEA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,228 copying moleculekit/share/pdb2pqr/residues/MEA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,230 copying moleculekit/share/pdb2pqr/residues/MEN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,233 copying moleculekit/share/pdb2pqr/residues/MEN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,235 copying moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,237 copying moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,240 copying moleculekit/share/pdb2pqr/residues/MLE.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,242 copying moleculekit/share/pdb2pqr/residues/MLE.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,244 copying moleculekit/share/pdb2pqr/residues/MLY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,246 copying moleculekit/share/pdb2pqr/residues/MLY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,249 copying moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,252 copying moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,254 copying moleculekit/share/pdb2pqr/residues/MME.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,256 copying moleculekit/share/pdb2pqr/residues/MME.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,259 copying moleculekit/share/pdb2pqr/residues/MMO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,261 copying moleculekit/share/pdb2pqr/residues/MMO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,263 copying moleculekit/share/pdb2pqr/residues/MVA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,265 copying moleculekit/share/pdb2pqr/residues/MVA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,268 copying moleculekit/share/pdb2pqr/residues/NAL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,270 copying moleculekit/share/pdb2pqr/residues/NAL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,272 copying moleculekit/share/pdb2pqr/residues/NCY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,275 copying moleculekit/share/pdb2pqr/residues/NCY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,277 copying moleculekit/share/pdb2pqr/residues/NLE.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,279 copying moleculekit/share/pdb2pqr/residues/NLE.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,281 copying moleculekit/share/pdb2pqr/residues/NVA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,284 copying moleculekit/share/pdb2pqr/residues/NVA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,286 copying moleculekit/share/pdb2pqr/residues/NZC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,288 copying moleculekit/share/pdb2pqr/residues/NZC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,291 copying moleculekit/share/pdb2pqr/residues/OCY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,293 copying moleculekit/share/pdb2pqr/residues/OCY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,296 copying moleculekit/share/pdb2pqr/residues/OMX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,298 copying moleculekit/share/pdb2pqr/residues/OMX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,300 copying moleculekit/share/pdb2pqr/residues/ONL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,303 copying moleculekit/share/pdb2pqr/residues/ONL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,305 copying moleculekit/share/pdb2pqr/residues/ORM.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,307 copying moleculekit/share/pdb2pqr/residues/ORM.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,309 copying moleculekit/share/pdb2pqr/residues/P1L.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,312 copying moleculekit/share/pdb2pqr/residues/P1L.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,314 copying moleculekit/share/pdb2pqr/residues/PCA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,317 copying moleculekit/share/pdb2pqr/residues/PCA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,319 copying moleculekit/share/pdb2pqr/residues/PRK.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,321 copying moleculekit/share/pdb2pqr/residues/PRK.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,324 copying moleculekit/share/pdb2pqr/residues/PTR.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,326 copying moleculekit/share/pdb2pqr/residues/PTR.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,329 copying moleculekit/share/pdb2pqr/residues/SEP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,331 copying moleculekit/share/pdb2pqr/residues/SEP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,333 copying moleculekit/share/pdb2pqr/residues/TPO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,336 copying moleculekit/share/pdb2pqr/residues/TPO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,338 copying moleculekit/share/pdb2pqr/residues/TRO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,340 copying moleculekit/share/pdb2pqr/residues/TRO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,342 copying moleculekit/share/pdb2pqr/residues/TY2.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,345 copying moleculekit/share/pdb2pqr/residues/TY2.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,347 copying moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,349 copying moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,352 copying moleculekit/share/pdb2pqr/residues/YCM.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,354 copying moleculekit/share/pdb2pqr/residues/YCM.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,356 copying moleculekit/share/pdb2pqr/residues/YNM.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,359 copying moleculekit/share/pdb2pqr/residues/YNM.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-06-05T13:51:18,361 creating build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-06-05T13:51:18,362 copying moleculekit/tmalign/tmalign_util.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-06-05T13:51:18,381 copying moleculekit/tmalign/tmalign_util.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-06-05T13:51:18,383 copying moleculekit/tmalign/tmalignlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-06-05T13:51:18,385 creating build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/include 2024-06-05T13:51:18,386 copying moleculekit/tmalign/include/TMAlign.h -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/include 2024-06-05T13:51:18,388 creating build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/src 2024-06-05T13:51:18,389 copying moleculekit/tmalign/src/TMAlign.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/src 2024-06-05T13:51:18,394 creating build/lib.linux-armv7l-cpython-311/moleculekit/wrapping 2024-06-05T13:51:18,395 copying moleculekit/wrapping/wrapping.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/wrapping 2024-06-05T13:51:18,414 copying moleculekit/wrapping/wrapping.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/wrapping 2024-06-05T13:51:18,416 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-06-05T13:51:18,418 copying moleculekit/interactions/cationpi/cationpi.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-06-05T13:51:18,437 copying moleculekit/interactions/cationpi/cationpi.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-06-05T13:51:18,439 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-06-05T13:51:18,440 copying moleculekit/interactions/hbonds/hbonds.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-06-05T13:51:18,468 copying moleculekit/interactions/hbonds/hbonds.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-06-05T13:51:18,470 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-06-05T13:51:18,471 copying moleculekit/interactions/pipi/pipi.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-06-05T13:51:18,493 copying moleculekit/interactions/pipi/pipi.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-06-05T13:51:18,495 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-06-05T13:51:18,496 copying moleculekit/interactions/sigmahole/sigmahole.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-06-05T13:51:18,515 copying moleculekit/interactions/sigmahole/sigmahole.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-06-05T13:51:18,518 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-06-05T13:51:18,519 copying moleculekit/fileformats/binpos/binpos.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-06-05T13:51:18,535 copying moleculekit/fileformats/binpos/binpos.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-06-05T13:51:18,537 copying moleculekit/fileformats/binpos/binposlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-06-05T13:51:18,539 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-06-05T13:51:18,541 copying moleculekit/fileformats/binpos/include/binposplugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-06-05T13:51:18,543 copying moleculekit/fileformats/binpos/include/largefiles.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-06-05T13:51:18,545 copying moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-06-05T13:51:18,548 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src 2024-06-05T13:51:18,550 copying moleculekit/fileformats/binpos/src/binposplugin.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src 2024-06-05T13:51:18,553 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-06-05T13:51:18,554 copying moleculekit/fileformats/dcd/dcd.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-06-05T13:51:18,571 copying moleculekit/fileformats/dcd/dcd.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-06-05T13:51:18,574 copying moleculekit/fileformats/dcd/dcdlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-06-05T13:51:18,576 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-06-05T13:51:18,577 copying moleculekit/fileformats/dcd/include/dcdplugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-06-05T13:51:18,579 copying moleculekit/fileformats/dcd/include/endianswap.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-06-05T13:51:18,582 copying moleculekit/fileformats/dcd/include/fastio.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-06-05T13:51:18,585 copying moleculekit/fileformats/dcd/include/largefiles.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-06-05T13:51:18,587 copying moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-06-05T13:51:18,591 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src 2024-06-05T13:51:18,591 copying moleculekit/fileformats/dcd/src/dcdplugin.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src 2024-06-05T13:51:18,594 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-06-05T13:51:18,595 copying moleculekit/fileformats/xtc/trr.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-06-05T13:51:18,615 copying moleculekit/fileformats/xtc/trr.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-06-05T13:51:18,618 copying moleculekit/fileformats/xtc/trrlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-06-05T13:51:18,620 copying moleculekit/fileformats/xtc/xdrlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-06-05T13:51:18,621 copying moleculekit/fileformats/xtc/xtc.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-06-05T13:51:18,645 copying moleculekit/fileformats/xtc/xtc.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-06-05T13:51:18,647 copying moleculekit/fileformats/xtc/xtclib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-06-05T13:51:18,648 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-06-05T13:51:18,649 copying moleculekit/fileformats/xtc/include/trr_header.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-06-05T13:51:18,651 copying moleculekit/fileformats/xtc/include/xdr_seek.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-06-05T13:51:18,653 copying moleculekit/fileformats/xtc/include/xdrfile.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-06-05T13:51:18,656 copying moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-06-05T13:51:18,658 copying moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-06-05T13:51:18,660 copying moleculekit/fileformats/xtc/include/xtc.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-06-05T13:51:18,662 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-06-05T13:51:18,663 copying moleculekit/fileformats/xtc/src/xdr_seek.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-06-05T13:51:18,665 copying moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-06-05T13:51:18,669 copying moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-06-05T13:51:18,671 copying moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-06-05T13:51:18,673 copying moleculekit/fileformats/xtc/src/xtc.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-06-05T13:51:18,684 UPDATING build/lib.linux-armv7l-cpython-311/moleculekit/_version.py 2024-06-05T13:51:18,685 set build/lib.linux-armv7l-cpython-311/moleculekit/_version.py to '1.8.33' 2024-06-05T13:51:18,686 running build_ext 2024-06-05T13:51:18,697 building 'moleculekit.interactions.hbonds' extension 2024-06-05T13:51:18,698 creating build/temp.linux-armv7l-cpython-311 2024-06-05T13:51:18,698 creating build/temp.linux-armv7l-cpython-311/moleculekit 2024-06-05T13:51:18,699 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions 2024-06-05T13:51:18,700 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-06-05T13:51:18,701 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/interactions/hbonds/hbonds.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/interactions/hbonds/hbonds.o -O3 2024-06-05T13:51:19,039 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:51:19,039 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:51:19,040 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:51:19,041 from moleculekit/interactions/hbonds/hbonds.cpp:1265: 2024-06-05T13:51:19,041 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:51:19,042 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:51:19,042 | ^~~~~~~ 2024-06-05T13:51:46,480 In function ‘PyObject* __pyx_pf_11moleculekit_12interactions_6hbonds_calculate(PyObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, float, float, bool, bool)’, 2024-06-05T13:51:46,480 inlined from ‘PyObject* __pyx_pw_11moleculekit_12interactions_6hbonds_1calculate(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/interactions/hbonds/hbonds.cpp:19989:68: 2024-06-05T13:51:46,481 moleculekit/interactions/hbonds/hbonds.cpp:21019:52: warning: ‘__pyx_v_d_idx_h’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:51:46,482 21019 | (__pyx_v_results[__pyx_v_f]).push_back(__pyx_v_d_idx_h); 2024-06-05T13:51:46,482 | ^~~~~~~~~~~~~~~ 2024-06-05T13:51:46,483 moleculekit/interactions/hbonds/hbonds.cpp: In function ‘PyObject* __pyx_pw_11moleculekit_12interactions_6hbonds_1calculate(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-06-05T13:51:46,484 moleculekit/interactions/hbonds/hbonds.cpp:20032:57: note: ‘__pyx_v_d_idx_h’ was declared here 2024-06-05T13:51:46,485 20032 | __pyx_t_11moleculekit_12interactions_6hbonds_UINT32_t __pyx_v_d_idx_h; 2024-06-05T13:51:46,486 | ^~~~~~~~~~~~~~~ 2024-06-05T13:51:49,494 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/interactions/hbonds/hbonds.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:51:49,777 building 'moleculekit.interactions.pipi' extension 2024-06-05T13:51:49,777 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-06-05T13:51:49,778 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/interactions/pipi/pipi.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/interactions/pipi/pipi.o -O3 2024-06-05T13:51:50,086 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:51:50,087 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:51:50,087 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:51:50,088 from moleculekit/interactions/pipi/pipi.cpp:1265: 2024-06-05T13:51:50,089 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:51:50,089 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:51:50,090 | ^~~~~~~ 2024-06-05T13:52:23,010 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/interactions/pipi/pipi.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:52:23,290 building 'moleculekit.interactions.cationpi' extension 2024-06-05T13:52:23,291 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-06-05T13:52:23,291 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/interactions/cationpi/cationpi.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/interactions/cationpi/cationpi.o -O3 2024-06-05T13:52:23,598 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:52:23,599 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:52:23,600 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:52:23,600 from moleculekit/interactions/cationpi/cationpi.cpp:1265: 2024-06-05T13:52:23,601 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:52:23,601 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:52:23,602 | ^~~~~~~ 2024-06-05T13:52:55,835 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/interactions/cationpi/cationpi.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:52:56,130 building 'moleculekit.interactions.sigmahole' extension 2024-06-05T13:52:56,130 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-06-05T13:52:56,131 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/interactions/sigmahole/sigmahole.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole/sigmahole.o -O3 2024-06-05T13:52:56,436 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:52:56,436 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:52:56,437 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:52:56,437 from moleculekit/interactions/sigmahole/sigmahole.cpp:1265: 2024-06-05T13:52:56,438 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:52:56,439 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:52:56,439 | ^~~~~~~ 2024-06-05T13:53:28,403 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole/sigmahole.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:53:28,693 building 'moleculekit.wrapping' extension 2024-06-05T13:53:28,694 creating build/temp.linux-armv7l-cpython-311/moleculekit/wrapping 2024-06-05T13:53:28,695 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/wrapping/wrapping.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/wrapping/wrapping.o -O3 2024-06-05T13:53:29,003 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:53:29,003 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:53:29,004 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:53:29,004 from moleculekit/wrapping/wrapping.cpp:1265: 2024-06-05T13:53:29,005 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:53:29,005 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:53:29,006 | ^~~~~~~ 2024-06-05T13:53:59,334 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/wrapping/wrapping.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/wrapping.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:53:59,533 building 'moleculekit.bondguesser_utils' extension 2024-06-05T13:53:59,533 creating build/temp.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-06-05T13:53:59,534 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/bondguesser_utils/bondguesser_utils.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/bondguesser_utils/bondguesser_utils.o -O3 2024-06-05T13:53:59,845 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:53:59,846 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:53:59,846 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:53:59,847 from moleculekit/bondguesser_utils/bondguesser_utils.cpp:1265: 2024-06-05T13:53:59,847 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:53:59,848 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:53:59,849 | ^~~~~~~ 2024-06-05T13:54:02,167 moleculekit/bondguesser_utils/bondguesser_utils.cpp: In function ‘PyObject* __pyx_pf_11moleculekit_17bondguesser_utils_make_grid_neighborlist_nonperiodic(PyObject*, __Pyx_memviewslice, __pyx_t_11moleculekit_17bondguesser_utils_UINT32_t, __pyx_t_11moleculekit_17bondguesser_utils_UINT32_t, __pyx_t_11moleculekit_17bondguesser_utils_UINT32_t)’: 2024-06-05T13:54:02,168 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19801:33: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-06-05T13:54:02,169 19801 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-06-05T13:54:02,169 | ~~~~~~~~~~^~~~~~~~~~~ 2024-06-05T13:54:02,170 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19813:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-06-05T13:54:02,170 19813 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-06-05T13:54:02,171 | ~~~~~~~~~~^~~~~~~~~~~ 2024-06-05T13:54:02,171 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19825:37: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-06-05T13:54:02,172 19825 | for (__pyx_t_9 = 0; __pyx_t_9 < __pyx_t_8; __pyx_t_9+=1) { 2024-06-05T13:54:02,173 | ~~~~~~~~~~^~~~~~~~~~~ 2024-06-05T13:54:02,173 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19864:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,174 19864 | __pyx_t_12 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T13:54:02,175 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,175 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19903:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,176 19903 | __pyx_t_12 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-06-05T13:54:02,177 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,178 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19942:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,178 19942 | __pyx_t_12 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T13:54:02,179 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,180 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19981:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,180 19981 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T13:54:02,181 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,181 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19987:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,182 19987 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-06-05T13:54:02,183 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,184 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20028:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,184 20028 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T13:54:02,185 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,186 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20034:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,186 20034 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T13:54:02,187 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,187 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20075:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,188 20075 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-06-05T13:54:02,188 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,189 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20081:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,189 20081 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T13:54:02,190 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,190 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20122:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,191 20122 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T13:54:02,192 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,192 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20175:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,193 20175 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T13:54:02,194 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,195 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20222:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,195 20222 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T13:54:02,196 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,196 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20263:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,197 20263 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T13:54:02,198 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,198 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20269:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,199 20269 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-06-05T13:54:02,200 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,200 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20275:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,201 20275 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T13:54:02,202 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,202 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20322:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,203 20322 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-06-05T13:54:02,204 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,205 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20328:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,206 20328 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T13:54:02,206 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,207 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20369:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,207 20369 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-06-05T13:54:02,208 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,208 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20381:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,209 20381 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T13:54:02,209 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,210 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20434:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-06-05T13:54:02,210 20434 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-06-05T13:54:02,211 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,218 moleculekit/bondguesser_utils/bondguesser_utils.cpp: In function ‘PyObject* __pyx_pf_11moleculekit_17bondguesser_utils_2grid_bonds(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, __Pyx_memviewslice, float, int, __Pyx_memviewslice, __Pyx_memviewslice)’: 2024-06-05T13:54:02,218 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21056:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T13:54:02,219 21056 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_n_boxes); 2024-06-05T13:54:02,220 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~ 2024-06-05T13:54:02,221 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21093:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T13:54:02,221 21093 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_boxidx); 2024-06-05T13:54:02,222 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-06-05T13:54:28,869 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/bondguesser_utils/bondguesser_utils.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:54:29,154 building 'moleculekit.atomselect_utils' extension 2024-06-05T13:54:29,155 creating build/temp.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-06-05T13:54:29,155 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/atomselect_utils/atomselect_utils.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/atomselect_utils/atomselect_utils.o -O3 2024-06-05T13:54:29,463 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:54:29,463 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:54:29,464 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:54:29,465 from moleculekit/atomselect_utils/atomselect_utils.cpp:1282: 2024-06-05T13:54:29,465 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:54:29,466 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:54:29,466 | ^~~~~~~ 2024-06-05T13:54:31,982 moleculekit/atomselect_utils/atomselect_utils.cpp: In function ‘bool __pyx_f_11moleculekit_16atomselect_utils__find_connected_subfragment(int, int, const char*, const char*, const char*, __Pyx_memviewslice, __Pyx_memviewslice, __Pyx_memviewslice, std::vector >&, __Pyx_memviewslice, std::vector >&, std::vector >&, std::vector >&)’: 2024-06-05T13:54:31,983 moleculekit/atomselect_utils/atomselect_utils.cpp:23255:161: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T13:54:31,983 23255 | __pyx_t_3 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_2 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_resnum); 2024-06-05T13:54:31,984 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-06-05T13:54:31,991 moleculekit/atomselect_utils/atomselect_utils.cpp: In function ‘bool __pyx_f_11moleculekit_16atomselect_utils__find_subfragments(int, std::vector >&, std::vector >&, __Pyx_memviewslice, __Pyx_memviewslice, __Pyx_memviewslice, std::vector >&, __Pyx_memviewslice, std::vector >&)’: 2024-06-05T13:54:31,992 moleculekit/atomselect_utils/atomselect_utils.cpp:23507:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T13:54:31,993 23507 | __pyx_t_6 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_5 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_i); 2024-06-05T13:54:31,993 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-06-05T13:54:32,000 moleculekit/atomselect_utils/atomselect_utils.cpp: In function ‘bool __pyx_f_11moleculekit_16atomselect_utils__find_subfragments_topologically(int, std::vector >&, std::vector >&, __Pyx_memviewslice, __Pyx_memviewslice, __Pyx_memviewslice, std::vector >&, __Pyx_memviewslice, std::vector >&)’: 2024-06-05T13:54:32,001 moleculekit/atomselect_utils/atomselect_utils.cpp:23774:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T13:54:32,002 23774 | __pyx_t_6 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_5 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_i); 2024-06-05T13:54:32,002 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-06-05T13:55:06,215 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/atomselect_utils/atomselect_utils.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:55:06,508 building 'moleculekit.distance_utils' extension 2024-06-05T13:55:06,509 creating build/temp.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-06-05T13:55:06,509 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/distance_utils/distance_utils.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/distance_utils/distance_utils.o -O3 2024-06-05T13:55:06,817 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:55:06,818 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:55:06,818 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:55:06,819 from moleculekit/distance_utils/distance_utils.cpp:1265: 2024-06-05T13:55:06,819 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:55:06,820 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:55:06,820 | ^~~~~~~ 2024-06-05T13:55:09,221 moleculekit/distance_utils/distance_utils.cpp: In function ‘PyObject* __pyx_pf_11moleculekit_14distance_utils_2get_collisions(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, float)’: 2024-06-05T13:55:09,221 moleculekit/distance_utils/distance_utils.cpp:21359:33: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_14distance_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T13:55:09,222 21359 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-06-05T13:55:09,223 | ~~~~~~~~~~^~~~~~~~~~~ 2024-06-05T13:55:09,223 moleculekit/distance_utils/distance_utils.cpp:21371:35: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_14distance_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-06-05T13:55:09,224 21371 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-06-05T13:55:09,225 | ~~~~~~~~~~^~~~~~~~~~~ 2024-06-05T13:55:46,443 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/distance_utils/distance_utils.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:55:46,732 building 'moleculekit.occupancy_utils' extension 2024-06-05T13:55:46,732 creating build/temp.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-06-05T13:55:46,733 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/occupancy_utils/occupancy_utils.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/occupancy_utils/occupancy_utils.o -O3 2024-06-05T13:55:47,072 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:55:47,072 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:55:47,073 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:55:47,074 from moleculekit/occupancy_utils/occupancy_utils.cpp:1265: 2024-06-05T13:55:47,074 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:55:47,075 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:55:47,075 | ^~~~~~~ 2024-06-05T13:56:14,232 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/occupancy_utils/occupancy_utils.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:56:14,417 building 'moleculekit.cython_utils' extension 2024-06-05T13:56:14,417 creating build/temp.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-06-05T13:56:14,418 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/cython_utils/cython_utils.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/cython_utils/cython_utils.o -O3 2024-06-05T13:56:14,720 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:56:14,721 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:56:14,722 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:56:14,722 from moleculekit/cython_utils/cython_utils.cpp:1265: 2024-06-05T13:56:14,723 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:56:14,723 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:56:14,724 | ^~~~~~~ 2024-06-05T13:56:44,595 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/cython_utils/cython_utils.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:56:44,866 building 'moleculekit.xtc' extension 2024-06-05T13:56:44,867 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats 2024-06-05T13:56:44,867 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-06-05T13:56:44,868 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-06-05T13:56:44,869 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/xtc -Imoleculekit/fileformats/xtc/include/ -Imoleculekit/fileformats/xtc/ -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/fileformats/xtc/src/xdrfile.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile.o 2024-06-05T13:56:45,553 moleculekit/fileformats/xtc/src/xdrfile.cpp:66:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,554 66 | "OK", 2024-06-05T13:56:45,555 | ^~~~ 2024-06-05T13:56:45,556 moleculekit/fileformats/xtc/src/xdrfile.cpp:67:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,556 67 | "Header", 2024-06-05T13:56:45,557 | ^~~~~~~~ 2024-06-05T13:56:45,558 moleculekit/fileformats/xtc/src/xdrfile.cpp:68:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,558 68 | "String", 2024-06-05T13:56:45,559 | ^~~~~~~~ 2024-06-05T13:56:45,559 moleculekit/fileformats/xtc/src/xdrfile.cpp:69:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,560 69 | "Double", 2024-06-05T13:56:45,560 | ^~~~~~~~ 2024-06-05T13:56:45,561 moleculekit/fileformats/xtc/src/xdrfile.cpp:70:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,561 70 | "Integer", 2024-06-05T13:56:45,562 | ^~~~~~~~~ 2024-06-05T13:56:45,562 moleculekit/fileformats/xtc/src/xdrfile.cpp:71:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,563 71 | "Float", 2024-06-05T13:56:45,564 | ^~~~~~~ 2024-06-05T13:56:45,564 moleculekit/fileformats/xtc/src/xdrfile.cpp:72:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,565 72 | "Unsigned integer", 2024-06-05T13:56:45,565 | ^~~~~~~~~~~~~~~~~~ 2024-06-05T13:56:45,566 moleculekit/fileformats/xtc/src/xdrfile.cpp:73:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,566 73 | "Compressed 3D coordinate", 2024-06-05T13:56:45,567 | ^~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:56:45,568 moleculekit/fileformats/xtc/src/xdrfile.cpp:74:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,569 74 | "Closing file", 2024-06-05T13:56:45,569 | ^~~~~~~~~~~~~~ 2024-06-05T13:56:45,570 moleculekit/fileformats/xtc/src/xdrfile.cpp:75:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,571 75 | "Magic number", 2024-06-05T13:56:45,572 | ^~~~~~~~~~~~~~ 2024-06-05T13:56:45,572 moleculekit/fileformats/xtc/src/xdrfile.cpp:76:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,573 76 | "Not enough memory", 2024-06-05T13:56:45,574 | ^~~~~~~~~~~~~~~~~~~ 2024-06-05T13:56:45,574 moleculekit/fileformats/xtc/src/xdrfile.cpp:77:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,575 77 | "End of file", 2024-06-05T13:56:45,576 | ^~~~~~~~~~~~~ 2024-06-05T13:56:45,576 moleculekit/fileformats/xtc/src/xdrfile.cpp:78:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-06-05T13:56:45,577 78 | "File not found" 2024-06-05T13:56:45,578 | ^~~~~~~~~~~~~~~~ 2024-06-05T13:56:45,578 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofint(int)’: 2024-06-05T13:56:45,579 moleculekit/fileformats/xtc/src/xdrfile.cpp:459:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,580 459 | while (size >= num && num_of_bits < 32) 2024-06-05T13:56:45,580 | ~~~~~^~~~~~ 2024-06-05T13:56:45,581 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-06-05T13:56:45,582 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:56:45,583 505 | while (bytes[num_of_bytes] >= num) 2024-06-05T13:56:45,583 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-06-05T13:56:45,584 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-06-05T13:56:45,584 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,585 614 | if (num_of_bits >= num_of_bytes * 8) 2024-06-05T13:56:45,585 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-06-05T13:56:45,586 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,586 616 | for (i = 0; i < num_of_bytes; i++) 2024-06-05T13:56:45,587 | ~~^~~~~~~~~~~~~~ 2024-06-05T13:56:45,587 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,588 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-06-05T13:56:45,588 | ~~^~~~~~~~~~~~~~~~ 2024-06-05T13:56:45,589 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-06-05T13:56:45,589 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:30: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:56:45,590 664 | if (lastbits < num_of_bits) 2024-06-05T13:56:45,590 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-06-05T13:56:45,591 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-06-05T13:56:45,592 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:56:45,592 785 | if(size3>xfp->buf1size) 2024-06-05T13:56:45,593 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T13:56:45,594 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:56:45,595 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-06-05T13:56:45,598 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:56:45,598 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,599 935 | if(countmjh >= size3 ) { return -1; } 2024-06-05T13:56:45,599 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:56:45,600 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,601 938 | if(countmjh >= size3 ) { return -1; } 2024-06-05T13:56:45,601 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:56:45,602 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,603 945 | if(countmjh >= size3 ) { return -1; } 2024-06-05T13:56:45,603 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:56:45,604 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,605 948 | if(countmjh >= size3 ) { return -1; } 2024-06-05T13:56:45,606 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:56:45,606 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,607 951 | if(countmjh >= size3 ) { return -1; } 2024-06-05T13:56:45,607 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:56:45,608 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:24: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-06-05T13:56:45,608 756 | int smallidx, minidx, maxidx; 2024-06-05T13:56:45,609 | ^~~~~~ 2024-06-05T13:56:45,609 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:32: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-06-05T13:56:45,610 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-06-05T13:56:45,610 | ^~~~~~ 2024-06-05T13:56:45,611 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:13: warning: unused variable ‘errval’ [-Wunused-variable] 2024-06-05T13:56:45,611 763 | int errval=1; 2024-06-05T13:56:45,612 | ^~~~~~ 2024-06-05T13:56:45,612 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-06-05T13:56:45,613 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:56:45,614 1011 | if(size3>xfp->buf1size) 2024-06-05T13:56:45,615 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T13:56:45,615 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:41: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,616 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T13:56:45,617 | ~~~~~~~~^~~~~~~ 2024-06-05T13:56:45,617 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,618 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T13:56:45,619 | ~~~~~~~~^~~~~~~ 2024-06-05T13:56:45,619 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,620 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T13:56:45,621 | ~~~~~~~~^~~~~~~ 2024-06-05T13:56:45,621 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,622 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-06-05T13:56:45,622 | ^ 2024-06-05T13:56:45,623 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:56:45,624 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-06-05T13:56:45,631 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T13:56:45,631 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:56:45,632 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-06-05T13:56:45,640 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T13:56:45,641 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:56:45,642 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-06-05T13:56:45,643 | ^ 2024-06-05T13:56:45,643 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:56:45,644 1633 | maxidx = (LASTIDX= num && num_of_bits < 32) 2024-06-05T13:57:15,913 | ~~~~~^~~~~~ 2024-06-05T13:57:15,915 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-06-05T13:57:15,915 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:57:15,916 505 | while (bytes[num_of_bytes] >= num) 2024-06-05T13:57:15,917 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-06-05T13:57:15,920 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-06-05T13:57:15,921 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,921 614 | if (num_of_bits >= num_of_bytes * 8) 2024-06-05T13:57:15,922 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:15,923 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,923 616 | for (i = 0; i < num_of_bytes; i++) 2024-06-05T13:57:15,924 | ~~^~~~~~~~~~~~~~ 2024-06-05T13:57:15,924 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,925 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-06-05T13:57:15,926 | ~~^~~~~~~~~~~~~~~~ 2024-06-05T13:57:15,927 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-06-05T13:57:15,928 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:30: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:57:15,929 664 | if (lastbits < num_of_bits) 2024-06-05T13:57:15,930 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-06-05T13:57:15,934 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-06-05T13:57:15,935 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:57:15,935 785 | if(size3>xfp->buf1size) 2024-06-05T13:57:15,935 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T13:57:15,938 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:57:15,939 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-06-05T13:57:15,946 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:57:15,947 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,947 935 | if(countmjh >= size3 ) { return -1; } 2024-06-05T13:57:15,949 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:57:15,949 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,950 938 | if(countmjh >= size3 ) { return -1; } 2024-06-05T13:57:15,951 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:57:15,952 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,953 945 | if(countmjh >= size3 ) { return -1; } 2024-06-05T13:57:15,954 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:57:15,956 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,956 948 | if(countmjh >= size3 ) { return -1; } 2024-06-05T13:57:15,957 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:57:15,958 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,959 951 | if(countmjh >= size3 ) { return -1; } 2024-06-05T13:57:15,960 | ~~~~~~~~~^~~~~~~~ 2024-06-05T13:57:15,960 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:24: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-06-05T13:57:15,962 756 | int smallidx, minidx, maxidx; 2024-06-05T13:57:15,963 | ^~~~~~ 2024-06-05T13:57:15,963 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:32: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-06-05T13:57:15,964 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-06-05T13:57:15,965 | ^~~~~~ 2024-06-05T13:57:15,966 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:13: warning: unused variable ‘errval’ [-Wunused-variable] 2024-06-05T13:57:15,967 763 | int errval=1; 2024-06-05T13:57:15,967 | ^~~~~~ 2024-06-05T13:57:15,968 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-06-05T13:57:15,968 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:57:15,969 1011 | if(size3>xfp->buf1size) 2024-06-05T13:57:15,970 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T13:57:15,970 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:41: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,971 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T13:57:15,971 | ~~~~~~~~^~~~~~~ 2024-06-05T13:57:15,972 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,973 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T13:57:15,973 | ~~~~~~~~^~~~~~~ 2024-06-05T13:57:15,974 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,974 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-06-05T13:57:15,975 | ~~~~~~~~^~~~~~~ 2024-06-05T13:57:15,976 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:15,976 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-06-05T13:57:15,977 | ^ 2024-06-05T13:57:15,978 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:57:15,978 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-06-05T13:57:15,993 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T13:57:15,996 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:57:15,996 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-06-05T13:57:16,010 | ~~~~~^~~~~~~~~~~~~~ 2024-06-05T13:57:16,016 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:57:16,016 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-06-05T13:57:16,017 | ^ 2024-06-05T13:57:16,017 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:57:16,018 1633 | maxidx = (LASTIDX= __pyx_pybuffernd_forces.diminfo[2].shape)) __pyx_t_4 = 2; 2024-06-05T13:57:55,964 | ^ 2024-06-05T13:57:55,972 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_forces.diminfo[2].shape’ was declared here 2024-06-05T13:57:55,973 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-06-05T13:57:55,974 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:55,983 moleculekit/fileformats/xtc/trr.c:11555:19: warning: ‘__pyx_pybuffernd_forces.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:55,984 11555 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_forces.diminfo[1].shape)) __pyx_t_4 = 1; 2024-06-05T13:57:55,984 | ^ 2024-06-05T13:57:55,993 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_forces.diminfo[1].shape’ was declared here 2024-06-05T13:57:55,994 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-06-05T13:57:55,994 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:55,995 moleculekit/fileformats/xtc/trr.c:2509:95: warning: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:55,996 2509 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-06-05T13:57:55,996 | ^ 2024-06-05T13:57:56,004 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ was declared here 2024-06-05T13:57:56,005 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-06-05T13:57:56,005 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,015 moleculekit/fileformats/xtc/trr.c:11549:59: warning: ‘__pyx_pybuffernd_forces.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,016 11549 | __pyx_t_28 += __pyx_pybuffernd_forces.diminfo[0].shape; 2024-06-05T13:57:56,016 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-06-05T13:57:56,025 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_forces.diminfo[0].shape’ was declared here 2024-06-05T13:57:56,026 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-06-05T13:57:56,026 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,036 moleculekit/fileformats/xtc/trr.c:11502:19: warning: ‘__pyx_pybuffernd_vel.diminfo[2].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,036 11502 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_vel.diminfo[2].shape)) __pyx_t_4 = 2; 2024-06-05T13:57:56,037 | ^ 2024-06-05T13:57:56,045 moleculekit/fileformats/xtc/trr.c:10107:21: note: ‘__pyx_pybuffernd_vel.diminfo[2].shape’ was declared here 2024-06-05T13:57:56,046 10107 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-06-05T13:57:56,047 | ^~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,056 moleculekit/fileformats/xtc/trr.c:11498:19: warning: ‘__pyx_pybuffernd_vel.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,057 11498 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_vel.diminfo[1].shape)) __pyx_t_4 = 1; 2024-06-05T13:57:56,058 | ^ 2024-06-05T13:57:56,066 moleculekit/fileformats/xtc/trr.c:10107:21: note: ‘__pyx_pybuffernd_vel.diminfo[1].shape’ was declared here 2024-06-05T13:57:56,067 10107 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-06-05T13:57:56,067 | ^~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,068 moleculekit/fileformats/xtc/trr.c:2509:95: warning: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,069 2509 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-06-05T13:57:56,070 | ^ 2024-06-05T13:57:56,077 moleculekit/fileformats/xtc/trr.c:10107:21: note: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ was declared here 2024-06-05T13:57:56,078 10107 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-06-05T13:57:56,079 | ^~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,088 moleculekit/fileformats/xtc/trr.c:11492:56: warning: ‘__pyx_pybuffernd_vel.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,089 11492 | __pyx_t_28 += __pyx_pybuffernd_vel.diminfo[0].shape; 2024-06-05T13:57:56,089 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-06-05T13:57:56,098 moleculekit/fileformats/xtc/trr.c:10107:21: note: ‘__pyx_pybuffernd_vel.diminfo[0].shape’ was declared here 2024-06-05T13:57:56,099 10107 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-06-05T13:57:56,099 | ^~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,109 moleculekit/fileformats/xtc/trr.c:11891:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,110 11891 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_xyz_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-06-05T13:57:56,110 | ^ 2024-06-05T13:57:56,119 moleculekit/fileformats/xtc/trr.c:10113:21: note: ‘__pyx_pybuffernd_xyz_buffer.diminfo[1].shape’ was declared here 2024-06-05T13:57:56,119 10113 | __Pyx_LocalBuf_ND __pyx_pybuffernd_xyz_buffer; 2024-06-05T13:57:56,120 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,129 moleculekit/fileformats/xtc/trr.c:11887:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,130 11887 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_xyz_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-06-05T13:57:56,130 | ^ 2024-06-05T13:57:56,139 moleculekit/fileformats/xtc/trr.c:10113:21: note: ‘__pyx_pybuffernd_xyz_buffer.diminfo[0].shape’ was declared here 2024-06-05T13:57:56,140 10113 | __Pyx_LocalBuf_ND __pyx_pybuffernd_xyz_buffer; 2024-06-05T13:57:56,140 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,150 moleculekit/fileformats/xtc/trr.c:11732:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,150 11732 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_vel_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-06-05T13:57:56,151 | ^ 2024-06-05T13:57:56,160 moleculekit/fileformats/xtc/trr.c:10109:21: note: ‘__pyx_pybuffernd_vel_buffer.diminfo[1].shape’ was declared here 2024-06-05T13:57:56,160 10109 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel_buffer; 2024-06-05T13:57:56,161 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,170 moleculekit/fileformats/xtc/trr.c:11728:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,171 11728 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_vel_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-06-05T13:57:56,172 | ^ 2024-06-05T13:57:56,180 moleculekit/fileformats/xtc/trr.c:10109:21: note: ‘__pyx_pybuffernd_vel_buffer.diminfo[0].shape’ was declared here 2024-06-05T13:57:56,181 10109 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel_buffer; 2024-06-05T13:57:56,182 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,191 moleculekit/fileformats/xtc/trr.c:11784:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,192 11784 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_forces_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-06-05T13:57:56,192 | ^ 2024-06-05T13:57:56,200 moleculekit/fileformats/xtc/trr.c:10093:21: note: ‘__pyx_pybuffernd_forces_buffer.diminfo[1].shape’ was declared here 2024-06-05T13:57:56,201 10093 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces_buffer; 2024-06-05T13:57:56,202 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:57:56,211 moleculekit/fileformats/xtc/trr.c:11780:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:57:56,212 11780 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_forces_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-06-05T13:57:56,212 | ^ 2024-06-05T13:57:56,221 moleculekit/fileformats/xtc/trr.c:10093:21: note: ‘__pyx_pybuffernd_forces_buffer.diminfo[0].shape’ was declared here 2024-06-05T13:57:56,222 10093 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces_buffer; 2024-06-05T13:57:56,223 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-06-05T13:58:02,755 arm-linux-gnueabihf-gcc -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdr_seek.o build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile.o build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile_trr.o build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/trr.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/trr.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:58:02,923 building 'moleculekit.dcd' extension 2024-06-05T13:58:02,923 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-06-05T13:58:02,924 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src 2024-06-05T13:58:02,925 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/dcd -Imoleculekit/fileformats/dcd/include/ -Imoleculekit/fileformats/dcd/ -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/fileformats/dcd/dcd.c -o build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcd.o 2024-06-05T13:58:03,320 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:58:03,320 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:58:03,321 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:58:03,321 from moleculekit/fileformats/dcd/dcd.c:1256: 2024-06-05T13:58:03,322 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:58:03,322 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:58:03,323 | ^~~~~~~ 2024-06-05T13:58:04,603 In file included from moleculekit/fileformats/dcd/include/dcdplugin.h:1, 2024-06-05T13:58:04,604 from moleculekit/fileformats/dcd/dcd.c:1262: 2024-06-05T13:58:04,605 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-06-05T13:58:04,605 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-06-05T13:58:04,606 | ^~~~~~~~~~~~~ 2024-06-05T13:58:04,607 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-06-05T13:58:04,608 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-06-05T13:58:04,609 | ^~~~~~~~~~~~~~ 2024-06-05T13:58:04,609 moleculekit/fileformats/dcd/include/fastio.h:466:12: warning: ‘fio_write_int32’ defined but not used [-Wunused-function] 2024-06-05T13:58:04,610 466 | static int fio_write_int32(fio_fd fd, int i) { 2024-06-05T13:58:04,611 | ^~~~~~~~~~~~~~~ 2024-06-05T13:58:04,611 moleculekit/fileformats/dcd/include/fastio.h:457:19: warning: ‘fio_ftell’ defined but not used [-Wunused-function] 2024-06-05T13:58:04,612 457 | static fio_size_t fio_ftell(fio_fd fd) { 2024-06-05T13:58:04,613 | ^~~~~~~~~ 2024-06-05T13:58:04,613 moleculekit/fileformats/dcd/include/fastio.h:450:19: warning: ‘fio_fseek’ defined but not used [-Wunused-function] 2024-06-05T13:58:04,615 450 | static fio_size_t fio_fseek(fio_fd fd, fio_size_t offset, int whence) { 2024-06-05T13:58:04,616 | ^~~~~~~~~ 2024-06-05T13:58:04,616 moleculekit/fileformats/dcd/include/fastio.h:415:19: warning: ‘fio_readv’ defined but not used [-Wunused-function] 2024-06-05T13:58:04,617 415 | static fio_size_t fio_readv(fio_fd fd, const fio_iovec * iov, int iovcnt) { 2024-06-05T13:58:04,618 | ^~~~~~~~~ 2024-06-05T13:58:04,619 moleculekit/fileformats/dcd/include/fastio.h:394:12: warning: ‘fio_fclose’ defined but not used [-Wunused-function] 2024-06-05T13:58:04,619 394 | static int fio_fclose(fio_fd fd) { 2024-06-05T13:58:04,619 | ^~~~~~~~~~ 2024-06-05T13:58:04,620 moleculekit/fileformats/dcd/include/fastio.h:366:12: warning: ‘fio_open’ defined but not used [-Wunused-function] 2024-06-05T13:58:04,620 366 | static int fio_open(const char *filename, int mode, fio_fd *fd) { 2024-06-05T13:58:04,621 | ^~~~~~~~ 2024-06-05T13:58:19,041 moleculekit/fileformats/dcd/dcd.c: In function ‘__pyx_pf_11moleculekit_3dcd_17DCDTrajectoryFile_18read’: 2024-06-05T13:58:19,041 moleculekit/fileformats/dcd/dcd.c:1158:40: warning: ‘__pyx_v_i’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:58:19,042 1158 | #define PyInt_FromLong PyLong_FromLong 2024-06-05T13:58:19,042 | ^~~~~~~~~~~~~~~ 2024-06-05T13:58:19,049 moleculekit/fileformats/dcd/dcd.c:8022:7: note: ‘__pyx_v_i’ was declared here 2024-06-05T13:58:19,050 8022 | int __pyx_v_i; 2024-06-05T13:58:19,050 | ^~~~~~~~~ 2024-06-05T13:58:22,393 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/dcd -Imoleculekit/fileformats/dcd/include/ -Imoleculekit/fileformats/dcd/ -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/fileformats/dcd/src/dcdplugin.c -o build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src/dcdplugin.o 2024-06-05T13:58:22,614 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdheader’: 2024-06-05T13:58:22,615 moleculekit/fileformats/dcd/src/dcdplugin.c:150:55: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:58:22,616 150 | else if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-06-05T13:58:22,616 | ^~ 2024-06-05T13:58:22,617 moleculekit/fileformats/dcd/src/dcdplugin.c:173:54: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:58:22,618 173 | if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-06-05T13:58:22,619 | ^~ 2024-06-05T13:58:22,619 moleculekit/fileformats/dcd/src/dcdplugin.c:194:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:58:22,620 194 | if (input_integer[0] != dcdcordmagic) 2024-06-05T13:58:22,621 | ^~ 2024-06-05T13:58:22,621 moleculekit/fileformats/dcd/src/dcdplugin.c:409:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:58:22,622 409 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-06-05T13:58:22,623 | ^~ 2024-06-05T13:58:22,623 moleculekit/fileformats/dcd/src/dcdplugin.c:428:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-06-05T13:58:22,624 428 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-06-05T13:58:22,625 | ^~ 2024-06-05T13:58:22,627 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdstep’: 2024-06-05T13:58:22,628 moleculekit/fileformats/dcd/src/dcdplugin.c:651:23: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:58:22,629 651 | if (tmpbuf[i] != sizeof(float) * N) 2024-06-05T13:58:22,629 | ^~ 2024-06-05T13:58:22,630 moleculekit/fileformats/dcd/src/dcdplugin.c:659:49: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-06-05T13:58:22,631 659 | if ((tmpbuf[2 * i] + tmpbuf[2 * i + 1]) != sizeof(float) * N) 2024-06-05T13:58:22,631 | ^~ 2024-06-05T13:58:22,657 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:55: 2024-06-05T13:58:22,657 moleculekit/fileformats/dcd/include/endianswap.h: At top level: 2024-06-05T13:58:22,658 moleculekit/fileformats/dcd/include/endianswap.h:96:13: warning: ‘swap2_aligned’ defined but not used [-Wunused-function] 2024-06-05T13:58:22,658 96 | static void swap2_aligned(void *v, long ndata) { 2024-06-05T13:58:22,659 | ^~~~~~~~~~~~~ 2024-06-05T13:58:22,659 moleculekit/fileformats/dcd/include/endianswap.h:32:13: warning: ‘swap2_unaligned’ defined but not used [-Wunused-function] 2024-06-05T13:58:22,660 32 | static void swap2_unaligned(void *v, long ndata) { 2024-06-05T13:58:22,660 | ^~~~~~~~~~~~~~~ 2024-06-05T13:58:22,661 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:46: 2024-06-05T13:58:22,662 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-06-05T13:58:22,662 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-06-05T13:58:22,663 | ^~~~~~~~~~~~~ 2024-06-05T13:58:22,663 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-06-05T13:58:22,664 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-06-05T13:58:22,665 | ^~~~~~~~~~~~~~ 2024-06-05T13:58:23,940 arm-linux-gnueabihf-gcc -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcd.o build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src/dcdplugin.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/dcd.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:58:24,068 building 'moleculekit.binpos' extension 2024-06-05T13:58:24,069 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-06-05T13:58:24,070 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src 2024-06-05T13:58:24,070 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/binpos -Imoleculekit/fileformats/binpos/include/ -Imoleculekit/fileformats/binpos/ -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/fileformats/binpos/binpos.c -o build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binpos.o 2024-06-05T13:58:24,459 In file included from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-06-05T13:58:24,460 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-06-05T13:58:24,461 from /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-06-05T13:58:24,461 from moleculekit/fileformats/binpos/binpos.c:1256: 2024-06-05T13:58:24,462 /tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-06-05T13:58:24,463 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-06-05T13:58:24,463 | ^~~~~~~ 2024-06-05T13:58:38,951 In function ‘__pyx_pf_11moleculekit_6binpos_20BINPOSTrajectoryFile_6_read’, 2024-06-05T13:58:38,952 inlined from ‘__pyx_pw_11moleculekit_6binpos_20BINPOSTrajectoryFile_7_read’ at moleculekit/fileformats/binpos/binpos.c:7504:13: 2024-06-05T13:58:38,959 moleculekit/fileformats/binpos/binpos.c:8045:6: warning: ‘__pyx_v_status’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:58:38,959 8045 | if (__pyx_t_1) { 2024-06-05T13:58:38,960 | ^ 2024-06-05T13:58:38,960 moleculekit/fileformats/binpos/binpos.c: In function ‘__pyx_pw_11moleculekit_6binpos_20BINPOSTrajectoryFile_7_read’: 2024-06-05T13:58:38,966 moleculekit/fileformats/binpos/binpos.c:7522:7: note: ‘__pyx_v_status’ was declared here 2024-06-05T13:58:38,966 7522 | int __pyx_v_status; 2024-06-05T13:58:38,967 | ^~~~~~~~~~~~~~ 2024-06-05T13:58:38,967 moleculekit/fileformats/binpos/binpos.c:1158:40: warning: ‘__pyx_v_i’ may be used uninitialized [-Wmaybe-uninitialized] 2024-06-05T13:58:38,968 1158 | #define PyInt_FromLong PyLong_FromLong 2024-06-05T13:58:38,968 | ^~~~~~~~~~~~~~~ 2024-06-05T13:58:38,974 moleculekit/fileformats/binpos/binpos.c:7519:7: note: ‘__pyx_v_i’ was declared here 2024-06-05T13:58:38,975 7519 | int __pyx_v_i; 2024-06-05T13:58:38,976 | ^~~~~~~~~ 2024-06-05T13:58:42,425 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/binpos -Imoleculekit/fileformats/binpos/include/ -Imoleculekit/fileformats/binpos/ -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/fileformats/binpos/src/binposplugin.c -o build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src/binposplugin.o 2024-06-05T13:58:42,757 arm-linux-gnueabihf-gcc -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binpos.o build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src/binposplugin.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/binpos.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:58:42,885 building 'moleculekit.tmalign' extension 2024-06-05T13:58:42,886 creating build/temp.linux-armv7l-cpython-311/moleculekit/tmalign 2024-06-05T13:58:42,886 creating build/temp.linux-armv7l-cpython-311/moleculekit/tmalign/src 2024-06-05T13:58:42,887 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/tmalign -Imoleculekit/tmalign/include/ -Imoleculekit/tmalign/ -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/tmalign/src/TMAlign.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/tmalign/src/TMAlign.o -w 2024-06-05T13:59:16,656 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/tmalign -Imoleculekit/tmalign/include/ -Imoleculekit/tmalign/ -I/tmp/pip-build-env-cpcib7j5/overlay/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c moleculekit/tmalign/tmalign_util.cpp -o build/temp.linux-armv7l-cpython-311/moleculekit/tmalign/tmalign_util.o -w 2024-06-05T13:59:39,217 In file included from /usr/include/c++/12/vector:70, 2024-06-05T13:59:39,218 from moleculekit/tmalign/tmalign_util.cpp:1280: 2024-06-05T13:59:39,218 /usr/include/c++/12/bits/vector.tcc: In member function ‘void std::vector<_Tp, _Alloc>::_M_realloc_insert(iterator, _Args&& ...) [with _Args = {const double&}; _Tp = double; _Alloc = std::allocator]’: 2024-06-05T13:59:39,219 /usr/include/c++/12/bits/vector.tcc:439:7: note: parameter passing for argument of type ‘std::vector::iterator’ changed in GCC 7.1 2024-06-05T13:59:39,220 439 | vector<_Tp, _Alloc>:: 2024-06-05T13:59:39,221 | ^~~~~~~~~~~~~~~~~~~ 2024-06-05T13:59:40,021 In file included from /usr/include/c++/12/vector:64: 2024-06-05T13:59:40,022 In member function ‘void std::vector<_Tp, _Alloc>::push_back(const value_type&) [with _Tp = double; _Alloc = std::allocator]’, 2024-06-05T13:59:40,022 inlined from ‘PyObject* __pyx_pf_11moleculekit_7tmalign_tmalign(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, std::string, std::string)’ at moleculekit/tmalign/tmalign_util.cpp:20779:32, 2024-06-05T13:59:40,023 inlined from ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/tmalign/tmalign_util.cpp:20264:52: 2024-06-05T13:59:40,023 /usr/include/c++/12/bits/stl_vector.h:1287:28: note: parameter passing for argument of type ‘__gnu_cxx::__normal_iterator >’ changed in GCC 7.1 2024-06-05T13:59:40,024 1287 | _M_realloc_insert(end(), __x); 2024-06-05T13:59:40,025 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-06-05T13:59:40,025 In member function ‘void std::vector<_Tp, _Alloc>::push_back(const value_type&) [with _Tp = double; _Alloc = std::allocator]’, 2024-06-05T13:59:40,026 inlined from ‘PyObject* __pyx_pf_11moleculekit_7tmalign_tmalign(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, std::string, std::string)’ at moleculekit/tmalign/tmalign_util.cpp:20793:33, 2024-06-05T13:59:40,026 inlined from ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/tmalign/tmalign_util.cpp:20264:52: 2024-06-05T13:59:40,027 /usr/include/c++/12/bits/stl_vector.h:1287:28: note: parameter passing for argument of type ‘__gnu_cxx::__normal_iterator >’ changed in GCC 7.1 2024-06-05T13:59:40,027 1287 | _M_realloc_insert(end(), __x); 2024-06-05T13:59:40,028 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-06-05T13:59:40,029 In member function ‘void std::vector<_Tp, _Alloc>::push_back(const value_type&) [with _Tp = double; _Alloc = std::allocator]’, 2024-06-05T13:59:40,029 inlined from ‘PyObject* __pyx_pf_11moleculekit_7tmalign_tmalign(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, std::string, std::string)’ at moleculekit/tmalign/tmalign_util.cpp:20878:34, 2024-06-05T13:59:40,030 inlined from ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/tmalign/tmalign_util.cpp:20264:52: 2024-06-05T13:59:40,031 /usr/include/c++/12/bits/stl_vector.h:1287:28: note: parameter passing for argument of type ‘__gnu_cxx::__normal_iterator >’ changed in GCC 7.1 2024-06-05T13:59:40,031 1287 | _M_realloc_insert(end(), __x); 2024-06-05T13:59:40,032 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-06-05T13:59:42,386 arm-linux-gnueabihf-g++ -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/moleculekit/tmalign/src/TMAlign.o build/temp.linux-armv7l-cpython-311/moleculekit/tmalign/tmalign_util.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/moleculekit/tmalign.cpython-311-arm-linux-gnueabihf.so 2024-06-05T13:59:42,774 UPDATING build/lib.linux-armv7l-cpython-311/moleculekit/_version.py 2024-06-05T13:59:42,775 set build/lib.linux-armv7l-cpython-311/moleculekit/_version.py to '1.8.33' 2024-06-05T13:59:42,775 installing to build/bdist.linux-armv7l/wheel 2024-06-05T13:59:42,776 running install 2024-06-05T13:59:42,799 running install_lib 2024-06-05T13:59:42,805 creating build/bdist.linux-armv7l 2024-06-05T13:59:42,806 creating build/bdist.linux-armv7l/wheel 2024-06-05T13:59:42,808 creating build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,810 copying build/lib.linux-armv7l-cpython-311/moleculekit/version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,812 copying build/lib.linux-armv7l-cpython-311/moleculekit/config.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,814 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,840 copying build/lib.linux-armv7l-cpython-311/moleculekit/opm.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,843 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,893 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-06-05T13:59:42,894 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/analyze.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-06-05T13:59:42,896 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/languageparser.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-06-05T13:59:42,899 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-06-05T13:59:42,900 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/atomselect.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-06-05T13:59:42,902 copying build/lib.linux-armv7l-cpython-311/moleculekit/readers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,907 creating build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-06-05T13:59:42,908 copying build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils/occupancy_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-06-05T13:59:42,911 copying build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils/occupancy_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-06-05T13:59:42,929 creating build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-06-05T13:59:42,930 copying build/lib.linux-armv7l-cpython-311/moleculekit/ply/yacc.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-06-05T13:59:42,934 copying build/lib.linux-armv7l-cpython-311/moleculekit/ply/lex.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-06-05T13:59:42,937 copying build/lib.linux-armv7l-cpython-311/moleculekit/ply/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-06-05T13:59:42,939 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-06-05T13:59:42,941 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-06-05T13:59:42,942 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-06-05T13:59:42,946 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-06-05T13:59:42,947 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/PdbxWriterTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-06-05T13:59:42,950 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/PdbxReaderTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-06-05T13:59:42,953 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-06-05T13:59:42,954 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-06-05T13:59:42,955 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer/PdbxWriter.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-06-05T13:59:42,958 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-06-05T13:59:42,960 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-06-05T13:59:42,962 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/PdbxParser.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-06-05T13:59:42,965 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/PdbxReader.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-06-05T13:59:42,968 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-06-05T13:59:42,970 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/PdbxContainers.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-06-05T13:59:42,972 copying build/lib.linux-armv7l-cpython-311/moleculekit/pymolgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,974 copying build/lib.linux-armv7l-cpython-311/moleculekit/home.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,976 copying build/lib.linux-armv7l-cpython-311/moleculekit/viewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,979 copying build/lib.linux-armv7l-cpython-311/moleculekit/_version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:42,980 copying build/lib.linux-armv7l-cpython-311/moleculekit/xtc.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,001 copying build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,018 copying build/lib.linux-armv7l-cpython-311/moleculekit/periodictable.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,020 copying build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,043 copying build/lib.linux-armv7l-cpython-311/moleculekit/trr.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,066 copying build/lib.linux-armv7l-cpython-311/moleculekit/logging.ini -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,068 creating build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,069 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricplumed2.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,072 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricrmsd.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,074 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metriccoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,076 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricsphericalcoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,078 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricfluctuation.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,081 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricdihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,083 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricdistance.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,086 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricsasa.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,089 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,090 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metrictmscore.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,092 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricgyration.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,094 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,096 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricshell.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,099 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/projection.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,100 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricsecondarystructure.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-06-05T13:59:43,103 copying build/lib.linux-armv7l-cpython-311/moleculekit/vmdgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,105 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,107 copying build/lib.linux-armv7l-cpython-311/moleculekit/molecule.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,111 copying build/lib.linux-armv7l-cpython-311/moleculekit/binpos.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,123 copying build/lib.linux-armv7l-cpython-311/moleculekit/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,125 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,127 creating build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,129 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/docking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,131 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/moleculechecks.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,134 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/modelling.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,136 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/sequencestructuralalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,139 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/detect.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,142 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/autosegment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,144 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/atomtyper.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,147 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/hhblitsprofile.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,149 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/voxeldescriptors.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,152 creating build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-06-05T13:59:43,154 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools/obabel_cli.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-06-05T13:59:43,156 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-06-05T13:59:43,158 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,160 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/graphalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,163 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/crystalpacking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,166 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/preparation.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,172 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/preparation_customres.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-06-05T13:59:43,175 creating build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-06-05T13:59:43,176 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils/distance_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-06-05T13:59:43,179 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils/distance_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-06-05T13:59:43,205 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T13:59:43,206 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-06-05T13:59:43,207 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds/hbonds.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-06-05T13:59:43,210 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds/hbonds.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-06-05T13:59:43,230 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/interactions.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T13:59:43,233 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-06-05T13:59:43,234 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole/sigmahole.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-06-05T13:59:43,236 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole/sigmahole.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-06-05T13:59:43,256 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T13:59:43,276 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T13:59:43,299 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-06-05T13:59:43,300 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi/cationpi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-06-05T13:59:43,303 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi/cationpi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-06-05T13:59:43,322 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T13:59:43,342 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T13:59:43,345 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-06-05T13:59:43,345 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi/pipi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-06-05T13:59:43,367 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi/pipi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-06-05T13:59:43,369 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-06-05T13:59:43,390 copying build/lib.linux-armv7l-cpython-311/moleculekit/dcd.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,403 copying build/lib.linux-armv7l-cpython-311/moleculekit/vmd_wrapper -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,406 creating build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-06-05T13:59:43,407 copying build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils/cython_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-06-05T13:59:43,427 copying build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils/cython_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-06-05T13:59:43,429 creating build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-06-05T13:59:43,430 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-06-05T13:59:43,432 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-06-05T13:59:43,455 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,480 copying build/lib.linux-armv7l-cpython-311/moleculekit/rdkitintegration.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,483 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,502 copying build/lib.linux-armv7l-cpython-311/moleculekit/dihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,504 copying build/lib.linux-armv7l-cpython-311/moleculekit/util.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,507 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-06-05T13:59:43,508 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/tmalignlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-06-05T13:59:43,511 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-06-05T13:59:43,512 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/include/TMAlign.h -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-06-05T13:59:43,514 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/tmalign_util.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-06-05T13:59:43,517 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-06-05T13:59:43,518 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/src/TMAlign.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-06-05T13:59:43,525 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/tmalign_util.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-06-05T13:59:43,545 creating build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-06-05T13:59:43,546 copying build/lib.linux-armv7l-cpython-311/moleculekit/wrapping/wrapping.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-06-05T13:59:43,548 copying build/lib.linux-armv7l-cpython-311/moleculekit/wrapping/wrapping.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-06-05T13:59:43,569 copying build/lib.linux-armv7l-cpython-311/moleculekit/align.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,571 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T13:59:43,572 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T13:59:43,575 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/test_smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T13:59:43,577 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/smallmolcdp.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T13:59:43,580 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T13:59:43,582 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-06-05T13:59:43,583 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/clustering.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-06-05T13:59:43,585 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-06-05T13:59:43,587 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/test_tools.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-06-05T13:59:43,589 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/restrainedembed.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-06-05T13:59:43,591 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/test_smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T13:59:43,593 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T13:59:43,595 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-06-05T13:59:43,598 copying build/lib.linux-armv7l-cpython-311/moleculekit/writers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:43,602 creating build/bdist.linux-armv7l/wheel/moleculekit/share 2024-06-05T13:59:43,603 creating build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-06-05T13:59:43,604 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/atomselect/atomselect.json -> build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-06-05T13:59:43,606 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/backbone.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-06-05T13:59:43,608 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr 2024-06-05T13:59:43,612 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,613 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TRO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,615 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BB8.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,616 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ORM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,618 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/P1L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,620 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,622 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HHK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,624 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/I2M.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,626 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/KYN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,627 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YNM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,629 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,631 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/M3L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,633 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,635 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DPP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,637 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,639 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ESC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,640 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,642 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/I2M.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,644 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BTK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,646 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,647 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0A1.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,649 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,651 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0AF.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,653 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/5JP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,654 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,656 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,658 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,660 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,662 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2GX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,664 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,665 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ONL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,667 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,669 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,670 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ONL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,672 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,674 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,676 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,678 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TY2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,679 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,681 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,683 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/03Y.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,684 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YCM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,686 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,688 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,690 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,691 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ME0.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,693 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,695 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,697 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/FGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,699 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BTK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,701 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,703 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,704 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,706 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,708 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/004.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,710 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GNC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,711 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GHG.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,713 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4IN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,715 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,717 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,718 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,720 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CGU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,722 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/D4P.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,723 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YNM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,725 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/D4P.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,727 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NAL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,729 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/M3L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,730 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HOX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,732 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,734 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DA2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,736 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BB8.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,738 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TPO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,740 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MMO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,742 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,744 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,746 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HPE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,747 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,749 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NAL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,751 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,753 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NZC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,755 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2ML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,756 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/004.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,758 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HOX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,759 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAB.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,761 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AHP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,763 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,764 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,766 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,767 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4IN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,769 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/1MH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,771 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TRO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,773 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/APD.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,775 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,777 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2AS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,779 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ABA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,780 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,782 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MMO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,784 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HYP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,786 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,788 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,790 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,792 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0BN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,794 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,795 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PCA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,797 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2GX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,799 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GNC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,801 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,803 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HHK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,804 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DPP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,806 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2MR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,807 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0AF.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,809 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AA4.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,811 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ABA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,812 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CGU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,814 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OMX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,816 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,818 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,820 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/FGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,821 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,823 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/03Y.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,825 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/1MH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,827 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,829 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HQA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,831 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,832 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/SEP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,834 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/APD.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,836 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IIL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,838 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,839 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,841 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2MR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,843 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TPO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,845 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,846 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,848 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HPE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,850 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAB.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,851 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,853 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PRK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,855 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OMX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,857 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,859 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,860 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,862 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PRK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,864 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0BN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,866 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/KYN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,867 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,869 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,871 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/5JP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,873 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0A1.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,874 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YCM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,876 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,878 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IIL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,879 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,881 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PCA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,883 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2ML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,884 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GHG.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,886 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AA4.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,888 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ESC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,889 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/SEP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,891 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2AS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,893 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,894 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,896 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TY2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,898 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/P1L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,901 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ME0.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,903 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,905 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,907 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NZC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,908 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HQA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,910 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/.gitkeep -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,912 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HYP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,914 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AHP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,916 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,917 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ORM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,919 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,921 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DA2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,922 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-06-05T13:59:43,924 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/ALA.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-06-05T13:59:43,926 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/opm_sequences.json -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-06-05T13:59:44,132 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-06-05T13:59:44,133 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-06-05T13:59:44,134 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binposlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-06-05T13:59:44,136 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-06-05T13:59:44,137 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-06-05T13:59:44,139 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include/binposplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-06-05T13:59:44,141 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-06-05T13:59:44,144 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binpos.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-06-05T13:59:44,146 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binpos.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-06-05T13:59:44,161 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-06-05T13:59:44,162 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src/binposplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-06-05T13:59:44,165 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-06-05T13:59:44,166 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcd.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-06-05T13:59:44,184 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T13:59:44,186 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T13:59:44,190 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/fastio.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T13:59:44,193 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/endianswap.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T13:59:44,196 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/dcdplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T13:59:44,199 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-06-05T13:59:44,202 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcd.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-06-05T13:59:44,205 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcdlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-06-05T13:59:44,208 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-06-05T13:59:44,209 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src/dcdplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-06-05T13:59:44,213 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T13:59:44,214 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xdrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T13:59:44,216 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T13:59:44,253 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xtclib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T13:59:44,256 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T13:59:44,257 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdr_seek.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T13:59:44,260 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdrfile.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T13:59:44,263 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T13:59:44,266 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T13:59:44,269 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/trr_header.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T13:59:44,271 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-06-05T13:59:44,274 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T13:59:44,294 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/trrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T13:59:44,296 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xtc.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T13:59:44,298 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/trr.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-06-05T13:59:44,301 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T13:59:44,302 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T13:59:44,304 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T13:59:44,308 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T13:59:44,310 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T13:59:44,312 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdr_seek.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-06-05T13:59:44,314 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/utils.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-06-05T13:59:44,316 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/netcdf.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-06-05T13:59:44,319 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-06-05T13:59:44,320 copying build/lib.linux-armv7l-cpython-311/moleculekit/vmdviewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:44,323 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-06-05T13:59:44,324 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils/atomselect_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-06-05T13:59:44,326 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils/atomselect_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-06-05T13:59:44,364 copying build/lib.linux-armv7l-cpython-311/moleculekit/rcsb.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:44,366 copying build/lib.linux-armv7l-cpython-311/moleculekit/wrapping.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-06-05T13:59:44,386 running install_egg_info 2024-06-05T13:59:44,391 Copying moleculekit.egg-info to build/bdist.linux-armv7l/wheel/moleculekit-1.8.33-py3.11.egg-info 2024-06-05T13:59:44,404 running install_scripts 2024-06-05T13:59:44,454 creating build/bdist.linux-armv7l/wheel/moleculekit-1.8.33.dist-info/WHEEL 2024-06-05T13:59:44,456 creating '/tmp/pip-wheel-migdce33/.tmp-91st8e8h/moleculekit-1.8.33-cp311-cp311-linux_armv7l.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2024-06-05T13:59:44,459 adding 'moleculekit/__init__.py' 2024-06-05T13:59:44,460 adding 'moleculekit/_version.py' 2024-06-05T13:59:44,462 adding 'moleculekit/align.py' 2024-06-05T13:59:44,792 adding 'moleculekit/atomselect_utils.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:44,957 adding 'moleculekit/binpos.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:44,963 adding 'moleculekit/bondguesser.py' 2024-06-05T13:59:45,214 adding 'moleculekit/bondguesser_utils.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:45,223 adding 'moleculekit/config.py' 2024-06-05T13:59:45,489 adding 'moleculekit/cython_utils.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:45,650 adding 'moleculekit/dcd.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:45,656 adding 'moleculekit/dihedral.py' 2024-06-05T13:59:45,657 adding 'moleculekit/distance.py' 2024-06-05T13:59:45,984 adding 'moleculekit/distance_utils.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:45,995 adding 'moleculekit/home.py' 2024-06-05T13:59:45,996 adding 'moleculekit/logging.ini' 2024-06-05T13:59:46,010 adding 'moleculekit/molecule.py' 2024-06-05T13:59:46,246 adding 'moleculekit/occupancy_utils.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:46,254 adding 'moleculekit/opm.py' 2024-06-05T13:59:46,256 adding 'moleculekit/periodictable.py' 2024-06-05T13:59:46,257 adding 'moleculekit/pymolgraphics.py' 2024-06-05T13:59:46,259 adding 'moleculekit/rcsb.py' 2024-06-05T13:59:46,260 adding 'moleculekit/rdkitintegration.py' 2024-06-05T13:59:46,273 adding 'moleculekit/readers.py' 2024-06-05T13:59:46,889 adding 'moleculekit/tmalign.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:47,202 adding 'moleculekit/trr.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:47,213 adding 'moleculekit/util.py' 2024-06-05T13:59:47,214 adding 'moleculekit/version.py' 2024-06-05T13:59:47,216 adding 'moleculekit/viewer.py' 2024-06-05T13:59:47,217 adding 'moleculekit/vmd_wrapper' 2024-06-05T13:59:47,219 adding 'moleculekit/vmdgraphics.py' 2024-06-05T13:59:47,221 adding 'moleculekit/vmdviewer.py' 2024-06-05T13:59:47,483 adding 'moleculekit/wrapping.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:47,497 adding 'moleculekit/writers.py' 2024-06-05T13:59:47,765 adding 'moleculekit/xtc.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:47,775 adding 'moleculekit/atomselect/__init__.py' 2024-06-05T13:59:47,776 adding 'moleculekit/atomselect/analyze.py' 2024-06-05T13:59:47,778 adding 'moleculekit/atomselect/atomselect.py' 2024-06-05T13:59:47,780 adding 'moleculekit/atomselect/languageparser.py' 2024-06-05T13:59:47,885 adding 'moleculekit/atomselect_utils/atomselect_utils.cpp' 2024-06-05T13:59:47,896 adding 'moleculekit/atomselect_utils/atomselect_utils.pyx' 2024-06-05T13:59:47,989 adding 'moleculekit/bondguesser_utils/bondguesser_utils.cpp' 2024-06-05T13:59:47,998 adding 'moleculekit/bondguesser_utils/bondguesser_utils.pyx' 2024-06-05T13:59:48,089 adding 'moleculekit/cython_utils/cython_utils.cpp' 2024-06-05T13:59:48,098 adding 'moleculekit/cython_utils/cython_utils.pyx' 2024-06-05T13:59:48,202 adding 'moleculekit/distance_utils/distance_utils.cpp' 2024-06-05T13:59:48,212 adding 'moleculekit/distance_utils/distance_utils.pyx' 2024-06-05T13:59:48,214 adding 'moleculekit/fileformats/__init__.py' 2024-06-05T13:59:48,219 adding 'moleculekit/fileformats/netcdf.py' 2024-06-05T13:59:48,221 adding 'moleculekit/fileformats/utils.py' 2024-06-05T13:59:48,281 adding 'moleculekit/fileformats/binpos/binpos.c' 2024-06-05T13:59:48,289 adding 'moleculekit/fileformats/binpos/binpos.pyx' 2024-06-05T13:59:48,290 adding 'moleculekit/fileformats/binpos/binposlib.pxd' 2024-06-05T13:59:48,292 adding 'moleculekit/fileformats/binpos/include/binposplugin.h' 2024-06-05T13:59:48,293 adding 'moleculekit/fileformats/binpos/include/largefiles.h' 2024-06-05T13:59:48,298 adding 'moleculekit/fileformats/binpos/include/molfile_plugin.h' 2024-06-05T13:59:48,300 adding 'moleculekit/fileformats/binpos/src/binposplugin.c' 2024-06-05T13:59:48,365 adding 'moleculekit/fileformats/dcd/dcd.c' 2024-06-05T13:59:48,372 adding 'moleculekit/fileformats/dcd/dcd.pyx' 2024-06-05T13:59:48,373 adding 'moleculekit/fileformats/dcd/dcdlib.pxd' 2024-06-05T13:59:48,375 adding 'moleculekit/fileformats/dcd/include/dcdplugin.h' 2024-06-05T13:59:48,377 adding 'moleculekit/fileformats/dcd/include/endianswap.h' 2024-06-05T13:59:48,379 adding 'moleculekit/fileformats/dcd/include/fastio.h' 2024-06-05T13:59:48,380 adding 'moleculekit/fileformats/dcd/include/largefiles.h' 2024-06-05T13:59:48,385 adding 'moleculekit/fileformats/dcd/include/molfile_plugin.h' 2024-06-05T13:59:48,390 adding 'moleculekit/fileformats/dcd/src/dcdplugin.c' 2024-06-05T13:59:48,487 adding 'moleculekit/fileformats/xtc/trr.c' 2024-06-05T13:59:48,498 adding 'moleculekit/fileformats/xtc/trr.pyx' 2024-06-05T13:59:48,499 adding 'moleculekit/fileformats/xtc/trrlib.pxd' 2024-06-05T13:59:48,501 adding 'moleculekit/fileformats/xtc/xdrlib.pxd' 2024-06-05T13:59:48,591 adding 'moleculekit/fileformats/xtc/xtc.cpp' 2024-06-05T13:59:48,600 adding 'moleculekit/fileformats/xtc/xtc.pyx' 2024-06-05T13:59:48,601 adding 'moleculekit/fileformats/xtc/xtclib.pxd' 2024-06-05T13:59:48,603 adding 'moleculekit/fileformats/xtc/include/trr_header.h' 2024-06-05T13:59:48,604 adding 'moleculekit/fileformats/xtc/include/xdr_seek.h' 2024-06-05T13:59:48,606 adding 'moleculekit/fileformats/xtc/include/xdrfile.h' 2024-06-05T13:59:48,608 adding 'moleculekit/fileformats/xtc/include/xdrfile_trr.h' 2024-06-05T13:59:48,609 adding 'moleculekit/fileformats/xtc/include/xdrfile_xtc.h' 2024-06-05T13:59:48,610 adding 'moleculekit/fileformats/xtc/include/xtc.h' 2024-06-05T13:59:48,612 adding 'moleculekit/fileformats/xtc/src/xdr_seek.c' 2024-06-05T13:59:48,619 adding 'moleculekit/fileformats/xtc/src/xdrfile.cpp' 2024-06-05T13:59:48,621 adding 'moleculekit/fileformats/xtc/src/xdrfile_trr.c' 2024-06-05T13:59:48,623 adding 'moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp' 2024-06-05T13:59:48,625 adding 'moleculekit/fileformats/xtc/src/xtc.cpp' 2024-06-05T13:59:48,626 adding 'moleculekit/interactions/__init__.py' 2024-06-05T13:59:48,913 adding 'moleculekit/interactions/cationpi.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:49,187 adding 'moleculekit/interactions/hbonds.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:49,198 adding 'moleculekit/interactions/interactions.py' 2024-06-05T13:59:49,483 adding 'moleculekit/interactions/pipi.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:49,774 adding 'moleculekit/interactions/sigmahole.cpython-311-arm-linux-gnueabihf.so' 2024-06-05T13:59:49,876 adding 'moleculekit/interactions/cationpi/cationpi.cpp' 2024-06-05T13:59:49,884 adding 'moleculekit/interactions/cationpi/cationpi.pyx' 2024-06-05T13:59:49,977 adding 'moleculekit/interactions/hbonds/hbonds.cpp' 2024-06-05T13:59:49,985 adding 'moleculekit/interactions/hbonds/hbonds.pyx' 2024-06-05T13:59:50,078 adding 'moleculekit/interactions/pipi/pipi.cpp' 2024-06-05T13:59:50,087 adding 'moleculekit/interactions/pipi/pipi.pyx' 2024-06-05T13:59:50,180 adding 'moleculekit/interactions/sigmahole/sigmahole.cpp' 2024-06-05T13:59:50,188 adding 'moleculekit/interactions/sigmahole/sigmahole.pyx' 2024-06-05T13:59:50,276 adding 'moleculekit/occupancy_utils/occupancy_utils.cpp' 2024-06-05T13:59:50,285 adding 'moleculekit/occupancy_utils/occupancy_utils.pyx' 2024-06-05T13:59:50,286 adding 'moleculekit/pdbx/__init__.py' 2024-06-05T13:59:50,290 adding 'moleculekit/pdbx/reader/PdbxContainers.py' 2024-06-05T13:59:50,292 adding 'moleculekit/pdbx/reader/PdbxParser.py' 2024-06-05T13:59:50,295 adding 'moleculekit/pdbx/reader/PdbxReader.py' 2024-06-05T13:59:50,296 adding 'moleculekit/pdbx/reader/__init__.py' 2024-06-05T13:59:50,298 adding 'moleculekit/pdbx/tests/PdbxReadWriteTests.py' 2024-06-05T13:59:50,299 adding 'moleculekit/pdbx/tests/PdbxReaderTests.py' 2024-06-05T13:59:50,300 adding 'moleculekit/pdbx/tests/PdbxWriterTests.py' 2024-06-05T13:59:50,302 adding 'moleculekit/pdbx/tests/__init__.py' 2024-06-05T13:59:50,303 adding 'moleculekit/pdbx/writer/PdbxWriter.py' 2024-06-05T13:59:50,305 adding 'moleculekit/pdbx/writer/__init__.py' 2024-06-05T13:59:50,306 adding 'moleculekit/ply/__init__.py' 2024-06-05T13:59:50,310 adding 'moleculekit/ply/lex.py' 2024-06-05T13:59:50,322 adding 'moleculekit/ply/yacc.py' 2024-06-05T13:59:50,324 adding 'moleculekit/projections/__init__.py' 2024-06-05T13:59:50,326 adding 'moleculekit/projections/metriccoordinate.py' 2024-06-05T13:59:50,329 adding 'moleculekit/projections/metricdihedral.py' 2024-06-05T13:59:50,333 adding 'moleculekit/projections/metricdistance.py' 2024-06-05T13:59:50,335 adding 'moleculekit/projections/metricfluctuation.py' 2024-06-05T13:59:50,337 adding 'moleculekit/projections/metricgyration.py' 2024-06-05T13:59:50,340 adding 'moleculekit/projections/metricplumed2.py' 2024-06-05T13:59:50,342 adding 'moleculekit/projections/metricrmsd.py' 2024-06-05T13:59:50,344 adding 'moleculekit/projections/metricsasa.py' 2024-06-05T13:59:50,346 adding 'moleculekit/projections/metricsecondarystructure.py' 2024-06-05T13:59:50,348 adding 'moleculekit/projections/metricshell.py' 2024-06-05T13:59:50,349 adding 'moleculekit/projections/metricsphericalcoordinate.py' 2024-06-05T13:59:50,351 adding 'moleculekit/projections/metrictmscore.py' 2024-06-05T13:59:50,352 adding 'moleculekit/projections/projection.py' 2024-06-05T13:59:50,353 adding 'moleculekit/projections/util.py' 2024-06-05T13:59:50,355 adding 'moleculekit/share/ALA.cif' 2024-06-05T13:59:50,357 adding 'moleculekit/share/backbone.cif' 2024-06-05T13:59:51,670 adding 'moleculekit/share/opm_sequences.json' 2024-06-05T13:59:51,755 adding 'moleculekit/share/atomselect/atomselect.json' 2024-06-05T13:59:51,760 adding 'moleculekit/share/pdb2pqr/residues/.gitkeep' 2024-06-05T13:59:51,761 adding 'moleculekit/share/pdb2pqr/residues/004.dat' 2024-06-05T13:59:51,762 adding 'moleculekit/share/pdb2pqr/residues/004.xml' 2024-06-05T13:59:51,764 adding 'moleculekit/share/pdb2pqr/residues/03Y.dat' 2024-06-05T13:59:51,765 adding 'moleculekit/share/pdb2pqr/residues/03Y.xml' 2024-06-05T13:59:51,766 adding 'moleculekit/share/pdb2pqr/residues/0A1.dat' 2024-06-05T13:59:51,767 adding 'moleculekit/share/pdb2pqr/residues/0A1.xml' 2024-06-05T13:59:51,768 adding 'moleculekit/share/pdb2pqr/residues/0AF.dat' 2024-06-05T13:59:51,769 adding 'moleculekit/share/pdb2pqr/residues/0AF.xml' 2024-06-05T13:59:51,770 adding 'moleculekit/share/pdb2pqr/residues/0BN.dat' 2024-06-05T13:59:51,772 adding 'moleculekit/share/pdb2pqr/residues/0BN.xml' 2024-06-05T13:59:51,773 adding 'moleculekit/share/pdb2pqr/residues/1MH.dat' 2024-06-05T13:59:51,774 adding 'moleculekit/share/pdb2pqr/residues/1MH.xml' 2024-06-05T13:59:51,775 adding 'moleculekit/share/pdb2pqr/residues/2AS.dat' 2024-06-05T13:59:51,776 adding 'moleculekit/share/pdb2pqr/residues/2AS.xml' 2024-06-05T13:59:51,777 adding 'moleculekit/share/pdb2pqr/residues/2GX.dat' 2024-06-05T13:59:51,778 adding 'moleculekit/share/pdb2pqr/residues/2GX.xml' 2024-06-05T13:59:51,780 adding 'moleculekit/share/pdb2pqr/residues/2ML.dat' 2024-06-05T13:59:51,781 adding 'moleculekit/share/pdb2pqr/residues/2ML.xml' 2024-06-05T13:59:51,782 adding 'moleculekit/share/pdb2pqr/residues/2MR.dat' 2024-06-05T13:59:51,783 adding 'moleculekit/share/pdb2pqr/residues/2MR.xml' 2024-06-05T13:59:51,785 adding 'moleculekit/share/pdb2pqr/residues/4IN.dat' 2024-06-05T13:59:51,786 adding 'moleculekit/share/pdb2pqr/residues/4IN.xml' 2024-06-05T13:59:51,787 adding 'moleculekit/share/pdb2pqr/residues/4PH.dat' 2024-06-05T13:59:51,788 adding 'moleculekit/share/pdb2pqr/residues/4PH.xml' 2024-06-05T13:59:51,789 adding 'moleculekit/share/pdb2pqr/residues/4PQ.dat' 2024-06-05T13:59:51,790 adding 'moleculekit/share/pdb2pqr/residues/4PQ.xml' 2024-06-05T13:59:51,791 adding 'moleculekit/share/pdb2pqr/residues/5JP.dat' 2024-06-05T13:59:51,792 adding 'moleculekit/share/pdb2pqr/residues/5JP.xml' 2024-06-05T13:59:51,794 adding 'moleculekit/share/pdb2pqr/residues/AA4.dat' 2024-06-05T13:59:51,795 adding 'moleculekit/share/pdb2pqr/residues/AA4.xml' 2024-06-05T13:59:51,796 adding 'moleculekit/share/pdb2pqr/residues/ABA.dat' 2024-06-05T13:59:51,797 adding 'moleculekit/share/pdb2pqr/residues/ABA.xml' 2024-06-05T13:59:51,798 adding 'moleculekit/share/pdb2pqr/residues/AHP.dat' 2024-06-05T13:59:51,800 adding 'moleculekit/share/pdb2pqr/residues/AHP.xml' 2024-06-05T13:59:51,801 adding 'moleculekit/share/pdb2pqr/residues/ALC.dat' 2024-06-05T13:59:51,802 adding 'moleculekit/share/pdb2pqr/residues/ALC.xml' 2024-06-05T13:59:51,803 adding 'moleculekit/share/pdb2pqr/residues/ALN.dat' 2024-06-05T13:59:51,804 adding 'moleculekit/share/pdb2pqr/residues/ALN.xml' 2024-06-05T13:59:51,806 adding 'moleculekit/share/pdb2pqr/residues/ALY.dat' 2024-06-05T13:59:51,807 adding 'moleculekit/share/pdb2pqr/residues/ALY.xml' 2024-06-05T13:59:51,808 adding 'moleculekit/share/pdb2pqr/residues/APD.dat' 2024-06-05T13:59:51,809 adding 'moleculekit/share/pdb2pqr/residues/APD.xml' 2024-06-05T13:59:51,810 adding 'moleculekit/share/pdb2pqr/residues/BB8.dat' 2024-06-05T13:59:51,812 adding 'moleculekit/share/pdb2pqr/residues/BB8.xml' 2024-06-05T13:59:51,813 adding 'moleculekit/share/pdb2pqr/residues/BCS.dat' 2024-06-05T13:59:51,814 adding 'moleculekit/share/pdb2pqr/residues/BCS.xml' 2024-06-05T13:59:51,815 adding 'moleculekit/share/pdb2pqr/residues/BTK.dat' 2024-06-05T13:59:51,817 adding 'moleculekit/share/pdb2pqr/residues/BTK.xml' 2024-06-05T13:59:51,818 adding 'moleculekit/share/pdb2pqr/residues/CCS.dat' 2024-06-05T13:59:51,819 adding 'moleculekit/share/pdb2pqr/residues/CCS.xml' 2024-06-05T13:59:51,820 adding 'moleculekit/share/pdb2pqr/residues/CGU.dat' 2024-06-05T13:59:51,822 adding 'moleculekit/share/pdb2pqr/residues/CGU.xml' 2024-06-05T13:59:51,823 adding 'moleculekit/share/pdb2pqr/residues/CSA.dat' 2024-06-05T13:59:51,824 adding 'moleculekit/share/pdb2pqr/residues/CSA.xml' 2024-06-05T13:59:51,825 adding 'moleculekit/share/pdb2pqr/residues/CSO.dat' 2024-06-05T13:59:51,826 adding 'moleculekit/share/pdb2pqr/residues/CSO.xml' 2024-06-05T13:59:51,828 adding 'moleculekit/share/pdb2pqr/residues/CSP.dat' 2024-06-05T13:59:51,829 adding 'moleculekit/share/pdb2pqr/residues/CSP.xml' 2024-06-05T13:59:51,830 adding 'moleculekit/share/pdb2pqr/residues/CSS.dat' 2024-06-05T13:59:51,831 adding 'moleculekit/share/pdb2pqr/residues/CSS.xml' 2024-06-05T13:59:51,832 adding 'moleculekit/share/pdb2pqr/residues/D4P.dat' 2024-06-05T13:59:51,833 adding 'moleculekit/share/pdb2pqr/residues/D4P.xml' 2024-06-05T13:59:51,834 adding 'moleculekit/share/pdb2pqr/residues/DA2.dat' 2024-06-05T13:59:51,835 adding 'moleculekit/share/pdb2pqr/residues/DA2.xml' 2024-06-05T13:59:51,836 adding 'moleculekit/share/pdb2pqr/residues/DAB.dat' 2024-06-05T13:59:51,837 adding 'moleculekit/share/pdb2pqr/residues/DAB.xml' 2024-06-05T13:59:51,839 adding 'moleculekit/share/pdb2pqr/residues/DAH.dat' 2024-06-05T13:59:51,840 adding 'moleculekit/share/pdb2pqr/residues/DAH.xml' 2024-06-05T13:59:51,841 adding 'moleculekit/share/pdb2pqr/residues/DPP.dat' 2024-06-05T13:59:51,842 adding 'moleculekit/share/pdb2pqr/residues/DPP.xml' 2024-06-05T13:59:51,843 adding 'moleculekit/share/pdb2pqr/residues/ESC.dat' 2024-06-05T13:59:51,844 adding 'moleculekit/share/pdb2pqr/residues/ESC.xml' 2024-06-05T13:59:51,846 adding 'moleculekit/share/pdb2pqr/residues/FGL.dat' 2024-06-05T13:59:51,847 adding 'moleculekit/share/pdb2pqr/residues/FGL.xml' 2024-06-05T13:59:51,848 adding 'moleculekit/share/pdb2pqr/residues/GHG.dat' 2024-06-05T13:59:51,849 adding 'moleculekit/share/pdb2pqr/residues/GHG.xml' 2024-06-05T13:59:51,850 adding 'moleculekit/share/pdb2pqr/residues/GME.dat' 2024-06-05T13:59:51,851 adding 'moleculekit/share/pdb2pqr/residues/GME.xml' 2024-06-05T13:59:51,852 adding 'moleculekit/share/pdb2pqr/residues/GNC.dat' 2024-06-05T13:59:51,854 adding 'moleculekit/share/pdb2pqr/residues/GNC.xml' 2024-06-05T13:59:51,855 adding 'moleculekit/share/pdb2pqr/residues/HHK.dat' 2024-06-05T13:59:51,856 adding 'moleculekit/share/pdb2pqr/residues/HHK.xml' 2024-06-05T13:59:51,857 adding 'moleculekit/share/pdb2pqr/residues/HLU.dat' 2024-06-05T13:59:51,858 adding 'moleculekit/share/pdb2pqr/residues/HLU.xml' 2024-06-05T13:59:51,860 adding 'moleculekit/share/pdb2pqr/residues/HLX.dat' 2024-06-05T13:59:51,861 adding 'moleculekit/share/pdb2pqr/residues/HLX.xml' 2024-06-05T13:59:51,862 adding 'moleculekit/share/pdb2pqr/residues/HOX.dat' 2024-06-05T13:59:51,863 adding 'moleculekit/share/pdb2pqr/residues/HOX.xml' 2024-06-05T13:59:51,864 adding 'moleculekit/share/pdb2pqr/residues/HPE.dat' 2024-06-05T13:59:51,866 adding 'moleculekit/share/pdb2pqr/residues/HPE.xml' 2024-06-05T13:59:51,867 adding 'moleculekit/share/pdb2pqr/residues/HQA.dat' 2024-06-05T13:59:51,868 adding 'moleculekit/share/pdb2pqr/residues/HQA.xml' 2024-06-05T13:59:51,869 adding 'moleculekit/share/pdb2pqr/residues/HTR.dat' 2024-06-05T13:59:51,871 adding 'moleculekit/share/pdb2pqr/residues/HTR.xml' 2024-06-05T13:59:51,872 adding 'moleculekit/share/pdb2pqr/residues/HYP.dat' 2024-06-05T13:59:51,873 adding 'moleculekit/share/pdb2pqr/residues/HYP.xml' 2024-06-05T13:59:51,874 adding 'moleculekit/share/pdb2pqr/residues/I2M.dat' 2024-06-05T13:59:51,875 adding 'moleculekit/share/pdb2pqr/residues/I2M.xml' 2024-06-05T13:59:51,876 adding 'moleculekit/share/pdb2pqr/residues/IGL.dat' 2024-06-05T13:59:51,878 adding 'moleculekit/share/pdb2pqr/residues/IGL.xml' 2024-06-05T13:59:51,879 adding 'moleculekit/share/pdb2pqr/residues/IIL.dat' 2024-06-05T13:59:51,880 adding 'moleculekit/share/pdb2pqr/residues/IIL.xml' 2024-06-05T13:59:51,881 adding 'moleculekit/share/pdb2pqr/residues/IML.dat' 2024-06-05T13:59:51,883 adding 'moleculekit/share/pdb2pqr/residues/IML.xml' 2024-06-05T13:59:51,884 adding 'moleculekit/share/pdb2pqr/residues/KYN.dat' 2024-06-05T13:59:51,885 adding 'moleculekit/share/pdb2pqr/residues/KYN.xml' 2024-06-05T13:59:51,886 adding 'moleculekit/share/pdb2pqr/residues/LME.dat' 2024-06-05T13:59:51,887 adding 'moleculekit/share/pdb2pqr/residues/LME.xml' 2024-06-05T13:59:51,889 adding 'moleculekit/share/pdb2pqr/residues/LMQ.dat' 2024-06-05T13:59:51,890 adding 'moleculekit/share/pdb2pqr/residues/LMQ.xml' 2024-06-05T13:59:51,891 adding 'moleculekit/share/pdb2pqr/residues/LYZ.dat' 2024-06-05T13:59:51,892 adding 'moleculekit/share/pdb2pqr/residues/LYZ.xml' 2024-06-05T13:59:51,893 adding 'moleculekit/share/pdb2pqr/residues/M3L.dat' 2024-06-05T13:59:51,895 adding 'moleculekit/share/pdb2pqr/residues/M3L.xml' 2024-06-05T13:59:51,896 adding 'moleculekit/share/pdb2pqr/residues/ME0.dat' 2024-06-05T13:59:51,897 adding 'moleculekit/share/pdb2pqr/residues/ME0.xml' 2024-06-05T13:59:51,898 adding 'moleculekit/share/pdb2pqr/residues/MEA.dat' 2024-06-05T13:59:51,899 adding 'moleculekit/share/pdb2pqr/residues/MEA.xml' 2024-06-05T13:59:51,900 adding 'moleculekit/share/pdb2pqr/residues/MEN.dat' 2024-06-05T13:59:51,901 adding 'moleculekit/share/pdb2pqr/residues/MEN.xml' 2024-06-05T13:59:51,902 adding 'moleculekit/share/pdb2pqr/residues/MEQ.dat' 2024-06-05T13:59:51,904 adding 'moleculekit/share/pdb2pqr/residues/MEQ.xml' 2024-06-05T13:59:51,905 adding 'moleculekit/share/pdb2pqr/residues/MLE.dat' 2024-06-05T13:59:51,906 adding 'moleculekit/share/pdb2pqr/residues/MLE.xml' 2024-06-05T13:59:51,907 adding 'moleculekit/share/pdb2pqr/residues/MLY.dat' 2024-06-05T13:59:51,908 adding 'moleculekit/share/pdb2pqr/residues/MLY.xml' 2024-06-05T13:59:51,910 adding 'moleculekit/share/pdb2pqr/residues/MLZ.dat' 2024-06-05T13:59:51,911 adding 'moleculekit/share/pdb2pqr/residues/MLZ.xml' 2024-06-05T13:59:51,912 adding 'moleculekit/share/pdb2pqr/residues/MME.dat' 2024-06-05T13:59:51,913 adding 'moleculekit/share/pdb2pqr/residues/MME.xml' 2024-06-05T13:59:51,914 adding 'moleculekit/share/pdb2pqr/residues/MMO.dat' 2024-06-05T13:59:51,916 adding 'moleculekit/share/pdb2pqr/residues/MMO.xml' 2024-06-05T13:59:51,917 adding 'moleculekit/share/pdb2pqr/residues/MVA.dat' 2024-06-05T13:59:51,918 adding 'moleculekit/share/pdb2pqr/residues/MVA.xml' 2024-06-05T13:59:51,919 adding 'moleculekit/share/pdb2pqr/residues/NAL.dat' 2024-06-05T13:59:51,921 adding 'moleculekit/share/pdb2pqr/residues/NAL.xml' 2024-06-05T13:59:51,922 adding 'moleculekit/share/pdb2pqr/residues/NCY.dat' 2024-06-05T13:59:51,923 adding 'moleculekit/share/pdb2pqr/residues/NCY.xml' 2024-06-05T13:59:51,924 adding 'moleculekit/share/pdb2pqr/residues/NLE.dat' 2024-06-05T13:59:51,925 adding 'moleculekit/share/pdb2pqr/residues/NLE.xml' 2024-06-05T13:59:51,927 adding 'moleculekit/share/pdb2pqr/residues/NVA.dat' 2024-06-05T13:59:51,928 adding 'moleculekit/share/pdb2pqr/residues/NVA.xml' 2024-06-05T13:59:51,929 adding 'moleculekit/share/pdb2pqr/residues/NZC.dat' 2024-06-05T13:59:51,930 adding 'moleculekit/share/pdb2pqr/residues/NZC.xml' 2024-06-05T13:59:51,931 adding 'moleculekit/share/pdb2pqr/residues/OCY.dat' 2024-06-05T13:59:51,933 adding 'moleculekit/share/pdb2pqr/residues/OCY.xml' 2024-06-05T13:59:51,934 adding 'moleculekit/share/pdb2pqr/residues/OMX.dat' 2024-06-05T13:59:51,935 adding 'moleculekit/share/pdb2pqr/residues/OMX.xml' 2024-06-05T13:59:51,936 adding 'moleculekit/share/pdb2pqr/residues/ONL.dat' 2024-06-05T13:59:51,938 adding 'moleculekit/share/pdb2pqr/residues/ONL.xml' 2024-06-05T13:59:51,939 adding 'moleculekit/share/pdb2pqr/residues/ORM.dat' 2024-06-05T13:59:51,940 adding 'moleculekit/share/pdb2pqr/residues/ORM.xml' 2024-06-05T13:59:51,941 adding 'moleculekit/share/pdb2pqr/residues/P1L.dat' 2024-06-05T13:59:51,943 adding 'moleculekit/share/pdb2pqr/residues/P1L.xml' 2024-06-05T13:59:51,944 adding 'moleculekit/share/pdb2pqr/residues/PCA.dat' 2024-06-05T13:59:51,945 adding 'moleculekit/share/pdb2pqr/residues/PCA.xml' 2024-06-05T13:59:51,946 adding 'moleculekit/share/pdb2pqr/residues/PRK.dat' 2024-06-05T13:59:51,948 adding 'moleculekit/share/pdb2pqr/residues/PRK.xml' 2024-06-05T13:59:51,949 adding 'moleculekit/share/pdb2pqr/residues/PTR.dat' 2024-06-05T13:59:51,950 adding 'moleculekit/share/pdb2pqr/residues/PTR.xml' 2024-06-05T13:59:51,951 adding 'moleculekit/share/pdb2pqr/residues/SEP.dat' 2024-06-05T13:59:51,952 adding 'moleculekit/share/pdb2pqr/residues/SEP.xml' 2024-06-05T13:59:51,953 adding 'moleculekit/share/pdb2pqr/residues/TPO.dat' 2024-06-05T13:59:51,955 adding 'moleculekit/share/pdb2pqr/residues/TPO.xml' 2024-06-05T13:59:51,956 adding 'moleculekit/share/pdb2pqr/residues/TRO.dat' 2024-06-05T13:59:51,957 adding 'moleculekit/share/pdb2pqr/residues/TRO.xml' 2024-06-05T13:59:51,959 adding 'moleculekit/share/pdb2pqr/residues/TY2.dat' 2024-06-05T13:59:51,960 adding 'moleculekit/share/pdb2pqr/residues/TY2.xml' 2024-06-05T13:59:51,961 adding 'moleculekit/share/pdb2pqr/residues/TYQ.dat' 2024-06-05T13:59:51,962 adding 'moleculekit/share/pdb2pqr/residues/TYQ.xml' 2024-06-05T13:59:51,963 adding 'moleculekit/share/pdb2pqr/residues/YCM.dat' 2024-06-05T13:59:51,965 adding 'moleculekit/share/pdb2pqr/residues/YCM.xml' 2024-06-05T13:59:51,966 adding 'moleculekit/share/pdb2pqr/residues/YNM.dat' 2024-06-05T13:59:51,967 adding 'moleculekit/share/pdb2pqr/residues/YNM.xml' 2024-06-05T13:59:51,969 adding 'moleculekit/smallmol/__init__.py' 2024-06-05T13:59:51,974 adding 'moleculekit/smallmol/smallmol.py' 2024-06-05T13:59:51,976 adding 'moleculekit/smallmol/smallmolcdp.py' 2024-06-05T13:59:51,978 adding 'moleculekit/smallmol/smallmollib.py' 2024-06-05T13:59:51,980 adding 'moleculekit/smallmol/test_smallmol.py' 2024-06-05T13:59:51,982 adding 'moleculekit/smallmol/test_smallmollib.py' 2024-06-05T13:59:51,984 adding 'moleculekit/smallmol/util.py' 2024-06-05T13:59:51,985 adding 'moleculekit/smallmol/tools/__init__.py' 2024-06-05T13:59:51,987 adding 'moleculekit/smallmol/tools/clustering.py' 2024-06-05T13:59:51,989 adding 'moleculekit/smallmol/tools/restrainedembed.py' 2024-06-05T13:59:51,990 adding 'moleculekit/smallmol/tools/test_tools.py' 2024-06-05T13:59:52,081 adding 'moleculekit/tmalign/tmalign_util.cpp' 2024-06-05T13:59:52,090 adding 'moleculekit/tmalign/tmalign_util.pyx' 2024-06-05T13:59:52,091 adding 'moleculekit/tmalign/tmalignlib.pxd' 2024-06-05T13:59:52,093 adding 'moleculekit/tmalign/include/TMAlign.h' 2024-06-05T13:59:52,110 adding 'moleculekit/tmalign/src/TMAlign.cpp' 2024-06-05T13:59:52,113 adding 'moleculekit/tools/__init__.py' 2024-06-05T13:59:52,115 adding 'moleculekit/tools/atomtyper.py' 2024-06-05T13:59:52,117 adding 'moleculekit/tools/autosegment.py' 2024-06-05T13:59:52,119 adding 'moleculekit/tools/crystalpacking.py' 2024-06-05T13:59:52,123 adding 'moleculekit/tools/detect.py' 2024-06-05T13:59:52,125 adding 'moleculekit/tools/docking.py' 2024-06-05T13:59:52,126 adding 'moleculekit/tools/graphalignment.py' 2024-06-05T13:59:52,128 adding 'moleculekit/tools/hhblitsprofile.py' 2024-06-05T13:59:52,129 adding 'moleculekit/tools/modelling.py' 2024-06-05T13:59:52,131 adding 'moleculekit/tools/moleculechecks.py' 2024-06-05T13:59:52,137 adding 'moleculekit/tools/preparation.py' 2024-06-05T13:59:52,139 adding 'moleculekit/tools/preparation_customres.py' 2024-06-05T13:59:52,141 adding 'moleculekit/tools/sequencestructuralalignment.py' 2024-06-05T13:59:52,144 adding 'moleculekit/tools/voxeldescriptors.py' 2024-06-05T13:59:52,146 adding 'moleculekit/tools/obabel_tools/__init__.py' 2024-06-05T13:59:52,147 adding 'moleculekit/tools/obabel_tools/obabel_cli.py' 2024-06-05T13:59:52,240 adding 'moleculekit/wrapping/wrapping.cpp' 2024-06-05T13:59:52,249 adding 'moleculekit/wrapping/wrapping.pyx' 2024-06-05T13:59:52,251 adding 'moleculekit-1.8.33.dist-info/LICENSE' 2024-06-05T13:59:52,253 adding 'moleculekit-1.8.33.dist-info/METADATA' 2024-06-05T13:59:52,253 adding 'moleculekit-1.8.33.dist-info/WHEEL' 2024-06-05T13:59:52,254 adding 'moleculekit-1.8.33.dist-info/top_level.txt' 2024-06-05T13:59:52,259 adding 'moleculekit-1.8.33.dist-info/RECORD' 2024-06-05T13:59:52,430 removing build/bdist.linux-armv7l/wheel 2024-06-05T13:59:52,737 Building wheel for moleculekit (pyproject.toml): finished with status 'done' 2024-06-05T13:59:53,096 Created wheel for moleculekit: filename=moleculekit-1.8.33-cp311-cp311-linux_armv7l.whl size=15274354 sha256=d0cfcf678117cf5ef4f82d9243483dc4716205e56e437386690ac215787c35cf 2024-06-05T13:59:53,098 Stored in directory: /tmp/pip-ephem-wheel-cache-to5xrh2r/wheels/42/e6/65/dbda37a1704ad45e561ba633a8da2c2d1900d7c349a0da97d6 2024-06-05T13:59:53,124 Successfully built moleculekit 2024-06-05T13:59:53,480 Removed build tracker: '/tmp/pip-build-tracker-d0e702au'