2024-02-26T10:08:08,215 Created temporary directory: /tmp/pip-build-tracker-fyvwymmw 2024-02-26T10:08:08,216 Initialized build tracking at /tmp/pip-build-tracker-fyvwymmw 2024-02-26T10:08:08,217 Created build tracker: /tmp/pip-build-tracker-fyvwymmw 2024-02-26T10:08:08,217 Entered build tracker: /tmp/pip-build-tracker-fyvwymmw 2024-02-26T10:08:08,218 Created temporary directory: /tmp/pip-wheel-s71q3o6e 2024-02-26T10:08:08,222 Created temporary directory: /tmp/pip-ephem-wheel-cache-3xuuhfjv 2024-02-26T10:08:08,244 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-02-26T10:08:08,247 2 location(s) to search for versions of moleculekit: 2024-02-26T10:08:08,247 * https://pypi.org/simple/moleculekit/ 2024-02-26T10:08:08,247 * https://www.piwheels.org/simple/moleculekit/ 2024-02-26T10:08:08,248 Fetching project page and analyzing links: https://pypi.org/simple/moleculekit/ 2024-02-26T10:08:08,248 Getting page https://pypi.org/simple/moleculekit/ 2024-02-26T10:08:08,250 Found index url https://pypi.org/simple/ 2024-02-26T10:08:08,402 Fetched page https://pypi.org/simple/moleculekit/ as application/vnd.pypi.simple.v1+json 2024-02-26T10:08:08,442 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/) 2024-02-26T10:08:08,442 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 2024-02-26T10:08:08,443 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/) 2024-02-26T10:08:08,444 Found link 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links for project 'moleculekit': discarding no candidates 2024-02-26T10:08:09,137 Collecting moleculekit==1.8.24 2024-02-26T10:08:09,139 Created temporary directory: /tmp/pip-unpack-fbjoontd 2024-02-26T10:08:09,477 Downloading moleculekit-1.8.24.tar.gz (6.8 MB) 2024-02-26T10:08:12,124 Added moleculekit==1.8.24 from https://files.pythonhosted.org/packages/64/72/c2549970c717c236688863287da25f453fbf8b3ea3dee071af9e96be6592/moleculekit-1.8.24.tar.gz to build tracker '/tmp/pip-build-tracker-fyvwymmw' 2024-02-26T10:08:12,133 Created temporary directory: /tmp/pip-build-env-me8oktgj 2024-02-26T10:08:12,137 Installing build dependencies: started 2024-02-26T10:08:12,138 Running command pip subprocess to install build dependencies 2024-02-26T10:08:13,278 Using pip 23.3.1 from /usr/local/lib/python3.11/dist-packages/pip (python 3.11) 2024-02-26T10:08:13,786 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-02-26T10:08:15,986 Collecting setuptools 2024-02-26T10:08:16,145 Using cached https://www.piwheels.org/simple/setuptools/setuptools-69.1.1-py3-none-any.whl (819 kB) 2024-02-26T10:08:16,760 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) 2024-02-26T10:08:16,763 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) 2024-02-26T10:08:16,767 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) 2024-02-26T10:08:16,770 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) 2024-02-26T10:08:16,773 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) 2024-02-26T10:08:17,042 Collecting numpy>=1.18.5 2024-02-26T10:08:17,057 Using cached https://www.piwheels.org/simple/numpy/numpy-1.26.4-cp311-cp311-linux_armv7l.whl (5.6 MB) 2024-02-26T10:08:18,489 Collecting Cython>=0.29.21 2024-02-26T10:08:18,503 Using cached https://www.piwheels.org/simple/cython/Cython-3.0.8-cp311-cp311-linux_armv7l.whl (11.7 MB) 2024-02-26T10:08:18,905 Collecting toml 2024-02-26T10:08:18,920 Using cached https://www.piwheels.org/simple/toml/toml-0.10.2-py2.py3-none-any.whl (16 kB) 2024-02-26T10:08:19,095 Collecting versioneer==0.28 (from versioneer[toml]==0.28) 2024-02-26T10:08:19,116 Using cached https://www.piwheels.org/simple/versioneer/versioneer-0.28-py3-none-any.whl (45 kB) 2024-02-26T10:08:21,758 Installing collected packages: versioneer, toml, setuptools, numpy, Cython 2024-02-26T10:08:21,790 Creating /tmp/pip-build-env-me8oktgj/overlay/local/bin 2024-02-26T10:08:21,792 changing mode of /tmp/pip-build-env-me8oktgj/overlay/local/bin/versioneer to 755 2024-02-26T10:08:32,266 changing mode of /tmp/pip-build-env-me8oktgj/overlay/local/bin/f2py to 755 2024-02-26T10:08:35,838 changing mode of /tmp/pip-build-env-me8oktgj/overlay/local/bin/cygdb to 755 2024-02-26T10:08:35,840 changing mode of /tmp/pip-build-env-me8oktgj/overlay/local/bin/cython to 755 2024-02-26T10:08:35,842 changing mode of /tmp/pip-build-env-me8oktgj/overlay/local/bin/cythonize to 755 2024-02-26T10:08:35,887 Successfully installed Cython-3.0.8 numpy-1.26.4 setuptools-69.1.1 toml-0.10.2 versioneer-0.28 2024-02-26T10:08:36,139 [notice] A new release of pip is available: 23.3.1 -> 24.0 2024-02-26T10:08:36,139 [notice] To update, run: python3 -m pip install --upgrade pip 2024-02-26T10:08:36,565 Installing build dependencies: finished with status 'done' 2024-02-26T10:08:36,568 Getting requirements to build wheel: started 2024-02-26T10:08:36,569 Running command Getting requirements to build wheel 2024-02-26T10:09:11,368 warning: moleculekit/wrapping/wrapping.pyx:47:4: Unreachable code 2024-02-26T10:09:19,456 Compiling moleculekit/interactions/hbonds/hbonds.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,457 Compiling moleculekit/interactions/pipi/pipi.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,457 Compiling moleculekit/interactions/cationpi/cationpi.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,458 Compiling moleculekit/interactions/sigmahole/sigmahole.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,458 Compiling moleculekit/wrapping/wrapping.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,459 Compiling moleculekit/bondguesser_utils/bondguesser_utils.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,459 Compiling moleculekit/atomselect_utils/atomselect_utils.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,460 Compiling moleculekit/distance_utils/distance_utils.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,460 Compiling moleculekit/occupancy_utils/occupancy_utils.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,461 Compiling moleculekit/cython_utils/cython_utils.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,462 Compiling moleculekit/fileformats/xtc/xtc.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-02-26T10:09:19,462 Compiling moleculekit/fileformats/xtc/trr.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-02-26T10:09:19,463 Compiling moleculekit/fileformats/dcd/dcd.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-02-26T10:09:19,463 Compiling moleculekit/fileformats/binpos/binpos.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-02-26T10:09:19,464 Compiling moleculekit/tmalign/tmalign_util.pyx because it depends on /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-02-26T10:09:19,464 [ 1/15] Cythonizing moleculekit/atomselect_utils/atomselect_utils.pyx 2024-02-26T10:09:19,465 [ 2/15] Cythonizing moleculekit/bondguesser_utils/bondguesser_utils.pyx 2024-02-26T10:09:19,466 [ 3/15] Cythonizing moleculekit/cython_utils/cython_utils.pyx 2024-02-26T10:09:19,466 [ 4/15] Cythonizing moleculekit/distance_utils/distance_utils.pyx 2024-02-26T10:09:19,467 [ 5/15] Cythonizing moleculekit/fileformats/dcd/dcd.pyx 2024-02-26T10:09:19,467 [ 6/15] Cythonizing moleculekit/interactions/cationpi/cationpi.pyx 2024-02-26T10:09:19,467 [ 7/15] Cythonizing moleculekit/interactions/hbonds/hbonds.pyx 2024-02-26T10:09:19,468 [ 8/15] Cythonizing moleculekit/interactions/pipi/pipi.pyx 2024-02-26T10:09:19,468 [ 9/15] Cythonizing moleculekit/interactions/sigmahole/sigmahole.pyx 2024-02-26T10:09:19,469 [10/15] Cythonizing moleculekit/occupancy_utils/occupancy_utils.pyx 2024-02-26T10:09:19,469 [11/15] Cythonizing moleculekit/tmalign/tmalign_util.pyx 2024-02-26T10:09:19,470 [12/15] Cythonizing moleculekit/wrapping/wrapping.pyx 2024-02-26T10:09:19,470 [13/15] Cythonizing moleculekit/fileformats/binpos/binpos.pyx 2024-02-26T10:09:19,471 [14/15] Cythonizing moleculekit/fileformats/xtc/trr.pyx 2024-02-26T10:09:19,471 [15/15] Cythonizing moleculekit/fileformats/xtc/xtc.pyx 2024-02-26T10:09:19,725 running egg_info 2024-02-26T10:09:19,731 writing moleculekit.egg-info/PKG-INFO 2024-02-26T10:09:19,735 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-02-26T10:09:19,737 writing requirements to moleculekit.egg-info/requires.txt 2024-02-26T10:09:19,738 writing top-level names to moleculekit.egg-info/top_level.txt 2024-02-26T10:09:19,766 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,766 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,767 dependency /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h won't be 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be automatically included in the manifest: the path must be relative 2024-02-26T10:09:19,782 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,783 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,783 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,783 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,784 dependency 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be automatically included in the manifest: the path must be relative 2024-02-26T10:09:19,786 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,786 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,787 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,787 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,788 dependency 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be automatically included in the manifest: the path must be relative 2024-02-26T10:09:19,790 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,791 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,791 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,792 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,792 dependency 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be automatically included in the manifest: the path must be relative 2024-02-26T10:09:19,795 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,795 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,796 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,796 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,797 dependency 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/tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,802 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,802 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,803 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,803 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:19,804 reading manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-02-26T10:09:19,831 reading manifest template 'MANIFEST.in' 2024-02-26T10:09:20,077 no previously-included directories found matching 'moleculekit/test-data' 2024-02-26T10:09:20,078 no previously-included directories found matching 'moleculekit/tests' 2024-02-26T10:09:20,080 no previously-included directories found matching 'package' 2024-02-26T10:09:20,081 adding license file 'LICENSE' 2024-02-26T10:09:20,096 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-02-26T10:09:21,547 Getting requirements to build wheel: finished with status 'done' 2024-02-26T10:09:21,561 Installing backend dependencies: started 2024-02-26T10:09:21,562 Running command pip subprocess to install backend dependencies 2024-02-26T10:09:22,797 Using pip 23.3.1 from /usr/local/lib/python3.11/dist-packages/pip (python 3.11) 2024-02-26T10:09:23,360 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-02-26T10:09:23,858 Collecting wheel 2024-02-26T10:09:27,715 Using cached https://www.piwheels.org/simple/wheel/wheel-0.42.0-py3-none-any.whl (65 kB) 2024-02-26T10:09:30,035 Installing collected packages: wheel 2024-02-26T10:09:30,256 Creating /tmp/pip-build-env-me8oktgj/normal/local/bin 2024-02-26T10:09:30,258 changing mode of /tmp/pip-build-env-me8oktgj/normal/local/bin/wheel to 755 2024-02-26T10:09:30,270 Successfully installed wheel-0.42.0 2024-02-26T10:09:30,522 [notice] A new release of pip is available: 23.3.1 -> 24.0 2024-02-26T10:09:30,522 [notice] To update, run: python3 -m pip install --upgrade pip 2024-02-26T10:09:30,752 Installing backend dependencies: finished with status 'done' 2024-02-26T10:09:30,753 Created temporary directory: /tmp/pip-modern-metadata-2psifa9u 2024-02-26T10:09:30,756 Preparing metadata (pyproject.toml): started 2024-02-26T10:09:30,757 Running command Preparing metadata (pyproject.toml) 2024-02-26T10:09:33,103 running dist_info 2024-02-26T10:09:33,105 creating /tmp/pip-modern-metadata-2psifa9u/moleculekit.egg-info 2024-02-26T10:09:33,111 writing /tmp/pip-modern-metadata-2psifa9u/moleculekit.egg-info/PKG-INFO 2024-02-26T10:09:33,115 writing dependency_links to /tmp/pip-modern-metadata-2psifa9u/moleculekit.egg-info/dependency_links.txt 2024-02-26T10:09:33,117 writing requirements to /tmp/pip-modern-metadata-2psifa9u/moleculekit.egg-info/requires.txt 2024-02-26T10:09:33,119 writing top-level names to /tmp/pip-modern-metadata-2psifa9u/moleculekit.egg-info/top_level.txt 2024-02-26T10:09:33,120 writing manifest file '/tmp/pip-modern-metadata-2psifa9u/moleculekit.egg-info/SOURCES.txt' 2024-02-26T10:09:33,152 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:33,152 dependency 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be automatically included in the manifest: the path must be relative 2024-02-26T10:09:33,190 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:33,190 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:33,191 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:33,191 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:33,192 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:33,192 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:33,193 reading manifest file '/tmp/pip-modern-metadata-2psifa9u/moleculekit.egg-info/SOURCES.txt' 2024-02-26T10:09:33,193 reading manifest template 'MANIFEST.in' 2024-02-26T10:09:33,443 no previously-included directories found matching 'moleculekit/test-data' 2024-02-26T10:09:33,444 no previously-included directories found matching 'moleculekit/tests' 2024-02-26T10:09:33,445 no previously-included directories found matching 'package' 2024-02-26T10:09:33,446 adding license file 'LICENSE' 2024-02-26T10:09:33,457 writing manifest file '/tmp/pip-modern-metadata-2psifa9u/moleculekit.egg-info/SOURCES.txt' 2024-02-26T10:09:33,465 creating '/tmp/pip-modern-metadata-2psifa9u/moleculekit-1.8.24.dist-info' 2024-02-26T10:09:33,696 Preparing metadata (pyproject.toml): finished with status 'done' 2024-02-26T10:09:33,700 Source in /tmp/pip-wheel-s71q3o6e/moleculekit_7661e9f33cf5453b81fdd302b1d28d8f has version 1.8.24, which satisfies requirement moleculekit==1.8.24 from https://files.pythonhosted.org/packages/64/72/c2549970c717c236688863287da25f453fbf8b3ea3dee071af9e96be6592/moleculekit-1.8.24.tar.gz 2024-02-26T10:09:33,701 Removed moleculekit==1.8.24 from https://files.pythonhosted.org/packages/64/72/c2549970c717c236688863287da25f453fbf8b3ea3dee071af9e96be6592/moleculekit-1.8.24.tar.gz from build tracker '/tmp/pip-build-tracker-fyvwymmw' 2024-02-26T10:09:33,707 Created temporary directory: /tmp/pip-unpack-12qg69kg 2024-02-26T10:09:33,708 Created temporary directory: /tmp/pip-unpack-i2z1hu88 2024-02-26T10:09:33,716 Building wheels for collected packages: moleculekit 2024-02-26T10:09:33,720 Created temporary directory: /tmp/pip-wheel-nyiu0sk5 2024-02-26T10:09:33,720 Destination directory: /tmp/pip-wheel-nyiu0sk5 2024-02-26T10:09:33,722 Building wheel for moleculekit (pyproject.toml): started 2024-02-26T10:09:33,723 Running command Building wheel for moleculekit (pyproject.toml) 2024-02-26T10:09:35,909 running bdist_wheel 2024-02-26T10:09:35,924 running build 2024-02-26T10:09:35,925 running build_py 2024-02-26T10:09:35,931 creating build 2024-02-26T10:09:35,932 creating build/lib.linux-armv7l-cpython-311 2024-02-26T10:09:35,932 creating build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,934 copying moleculekit/align.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,936 copying moleculekit/opm.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,939 copying moleculekit/version.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,940 copying moleculekit/vmdgraphics.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,943 copying moleculekit/viewer.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,945 copying moleculekit/pymolgraphics.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,947 copying moleculekit/home.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,948 copying moleculekit/writers.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,952 copying moleculekit/dihedral.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,954 copying moleculekit/distance.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,956 copying moleculekit/periodictable.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,959 copying moleculekit/config.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,961 copying moleculekit/bondguesser.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,963 copying moleculekit/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,965 copying moleculekit/rcsb.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,967 copying moleculekit/molecule.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,971 copying moleculekit/rdkitintegration.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,973 copying moleculekit/_version.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,975 copying moleculekit/vmdviewer.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,978 copying moleculekit/util.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,980 copying moleculekit/readers.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:35,985 creating build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-02-26T10:09:35,987 copying moleculekit/atomselect/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-02-26T10:09:35,988 copying moleculekit/atomselect/languageparser.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-02-26T10:09:35,991 copying moleculekit/atomselect/analyze.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-02-26T10:09:35,993 copying moleculekit/atomselect/atomselect.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-02-26T10:09:35,996 creating build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:35,997 copying moleculekit/tools/voxeldescriptors.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,000 copying moleculekit/tools/hhblitsprofile.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,002 copying moleculekit/tools/crystalpacking.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,005 copying moleculekit/tools/graphalignment.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,008 copying moleculekit/tools/modelling.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,010 copying moleculekit/tools/moleculechecks.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,012 copying moleculekit/tools/detect.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,015 copying moleculekit/tools/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,017 copying moleculekit/tools/docking.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,020 copying moleculekit/tools/sequencestructuralalignment.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,022 copying moleculekit/tools/autosegment.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,025 copying moleculekit/tools/preparation_customres.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,027 copying moleculekit/tools/atomtyper.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,030 copying moleculekit/tools/preparation.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-02-26T10:09:36,034 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx 2024-02-26T10:09:36,035 copying moleculekit/pdbx/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx 2024-02-26T10:09:36,038 creating build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,039 copying moleculekit/projections/metrictmscore.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,042 copying moleculekit/projections/metricfluctuation.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,045 copying moleculekit/projections/metricdihedral.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,048 copying moleculekit/projections/metricplumed2.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,051 copying moleculekit/projections/metricrmsd.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,053 copying moleculekit/projections/metricdistance.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,056 copying moleculekit/projections/metricsphericalcoordinate.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,059 copying moleculekit/projections/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,061 copying moleculekit/projections/metricgyration.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,063 copying moleculekit/projections/metricshell.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,066 copying moleculekit/projections/metricsasa.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,068 copying moleculekit/projections/metricsecondarystructure.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,071 copying moleculekit/projections/projection.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,073 copying moleculekit/projections/metriccoordinate.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,075 copying moleculekit/projections/util.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-02-26T10:09:36,078 creating build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-02-26T10:09:36,079 copying moleculekit/ply/lex.py -> build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-02-26T10:09:36,083 copying moleculekit/ply/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-02-26T10:09:36,085 copying moleculekit/ply/yacc.py -> build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-02-26T10:09:36,090 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-02-26T10:09:36,091 copying moleculekit/fileformats/netcdf.py -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-02-26T10:09:36,094 copying moleculekit/fileformats/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-02-26T10:09:36,096 copying moleculekit/fileformats/utils.py -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-02-26T10:09:36,098 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions 2024-02-26T10:09:36,099 copying moleculekit/interactions/interactions.py -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions 2024-02-26T10:09:36,102 copying moleculekit/interactions/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions 2024-02-26T10:09:36,104 creating build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-02-26T10:09:36,105 copying moleculekit/smallmol/smallmol.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-02-26T10:09:36,109 copying moleculekit/smallmol/test_smallmollib.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-02-26T10:09:36,111 copying moleculekit/smallmol/test_smallmol.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-02-26T10:09:36,113 copying moleculekit/smallmol/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-02-26T10:09:36,115 copying moleculekit/smallmol/smallmollib.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-02-26T10:09:36,118 copying moleculekit/smallmol/util.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-02-26T10:09:36,120 creating build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools 2024-02-26T10:09:36,121 copying moleculekit/tools/obabel_tools/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools 2024-02-26T10:09:36,123 copying moleculekit/tools/obabel_tools/obabel_cli.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools 2024-02-26T10:09:36,126 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-02-26T10:09:36,126 copying moleculekit/pdbx/tests/PdbxWriterTests.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-02-26T10:09:36,128 copying moleculekit/pdbx/tests/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-02-26T10:09:36,130 copying moleculekit/pdbx/tests/PdbxReaderTests.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-02-26T10:09:36,132 copying moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-02-26T10:09:36,134 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-02-26T10:09:36,135 copying moleculekit/pdbx/reader/PdbxParser.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-02-26T10:09:36,138 copying moleculekit/pdbx/reader/PdbxReader.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-02-26T10:09:36,140 copying moleculekit/pdbx/reader/PdbxContainers.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-02-26T10:09:36,143 copying moleculekit/pdbx/reader/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-02-26T10:09:36,145 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer 2024-02-26T10:09:36,145 copying moleculekit/pdbx/writer/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer 2024-02-26T10:09:36,147 copying moleculekit/pdbx/writer/PdbxWriter.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer 2024-02-26T10:09:36,150 creating build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-02-26T10:09:36,151 copying moleculekit/smallmol/tools/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-02-26T10:09:36,153 copying moleculekit/smallmol/tools/restrainedembed.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-02-26T10:09:36,154 copying moleculekit/smallmol/tools/clustering.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-02-26T10:09:36,157 copying moleculekit/smallmol/tools/test_tools.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-02-26T10:09:36,159 running egg_info 2024-02-26T10:09:36,164 writing moleculekit.egg-info/PKG-INFO 2024-02-26T10:09:36,167 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-02-26T10:09:36,168 writing requirements to moleculekit.egg-info/requires.txt 2024-02-26T10:09:36,169 writing top-level names to moleculekit.egg-info/top_level.txt 2024-02-26T10:09:36,186 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,187 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,187 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,188 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,188 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,189 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,190 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,190 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,191 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,191 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,191 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,192 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,192 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,193 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,193 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,194 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,194 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,195 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,195 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,196 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,197 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,197 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,198 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,198 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,199 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,200 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,200 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,201 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,201 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,202 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,202 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,203 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,203 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,204 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,204 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,205 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,205 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,206 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,206 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,207 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,207 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,208 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,209 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,209 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,210 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,210 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,211 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,211 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,211 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,212 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,212 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,213 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,213 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,214 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,214 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,215 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,215 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,216 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,217 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,217 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,218 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,219 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,219 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,220 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,220 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,220 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,221 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,221 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,222 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,222 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,223 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,224 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,224 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,225 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,225 dependency /tmp/pip-build-env-me8oktgj/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 2024-02-26T10:09:36,226 reading manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-02-26T10:09:36,226 reading manifest template 'MANIFEST.in' 2024-02-26T10:09:36,457 no previously-included directories found matching 'moleculekit/test-data' 2024-02-26T10:09:36,458 no previously-included directories found matching 'moleculekit/tests' 2024-02-26T10:09:36,459 no previously-included directories found matching 'package' 2024-02-26T10:09:36,460 adding license file 'LICENSE' 2024-02-26T10:09:36,475 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-02-26T10:09:36,500 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.atomselect_utils' is absent from the `packages` configuration. 2024-02-26T10:09:36,500 !! 2024-02-26T10:09:36,502 ******************************************************************************** 2024-02-26T10:09:36,502 ############################ 2024-02-26T10:09:36,502 # Package would be ignored # 2024-02-26T10:09:36,503 ############################ 2024-02-26T10:09:36,503 Python recognizes 'moleculekit.atomselect_utils' as an importable package[^1], 2024-02-26T10:09:36,504 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,504 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,505 package, please make sure that 'moleculekit.atomselect_utils' is explicitly added 2024-02-26T10:09:36,505 to the `packages` configuration field. 2024-02-26T10:09:36,506 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,507 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,507 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,508 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,509 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,510 If you don't want 'moleculekit.atomselect_utils' to be distributed and are 2024-02-26T10:09:36,510 already explicitly excluding 'moleculekit.atomselect_utils' via 2024-02-26T10:09:36,510 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,511 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,511 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,512 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,513 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,515 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,515 even if it does not contain any `.py` files. 2024-02-26T10:09:36,516 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,517 directory, all directories are treated like packages. 2024-02-26T10:09:36,517 ******************************************************************************** 2024-02-26T10:09:36,518 !! 2024-02-26T10:09:36,519 check.warn(importable) 2024-02-26T10:09:36,519 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.bondguesser_utils' is absent from the `packages` configuration. 2024-02-26T10:09:36,520 !! 2024-02-26T10:09:36,521 ******************************************************************************** 2024-02-26T10:09:36,522 ############################ 2024-02-26T10:09:36,522 # Package would be ignored # 2024-02-26T10:09:36,523 ############################ 2024-02-26T10:09:36,523 Python recognizes 'moleculekit.bondguesser_utils' as an importable package[^1], 2024-02-26T10:09:36,524 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,525 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,525 package, please make sure that 'moleculekit.bondguesser_utils' is explicitly added 2024-02-26T10:09:36,526 to the `packages` configuration field. 2024-02-26T10:09:36,527 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,527 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,528 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,529 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,530 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,530 If you don't want 'moleculekit.bondguesser_utils' to be distributed and are 2024-02-26T10:09:36,531 already explicitly excluding 'moleculekit.bondguesser_utils' via 2024-02-26T10:09:36,531 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,531 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,532 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,532 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,533 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,534 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,534 even if it does not contain any `.py` files. 2024-02-26T10:09:36,535 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,535 directory, all directories are treated like packages. 2024-02-26T10:09:36,535 ******************************************************************************** 2024-02-26T10:09:36,536 !! 2024-02-26T10:09:36,537 check.warn(importable) 2024-02-26T10:09:36,537 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.cython_utils' is absent from the `packages` configuration. 2024-02-26T10:09:36,537 !! 2024-02-26T10:09:36,538 ******************************************************************************** 2024-02-26T10:09:36,539 ############################ 2024-02-26T10:09:36,539 # Package would be ignored # 2024-02-26T10:09:36,540 ############################ 2024-02-26T10:09:36,540 Python recognizes 'moleculekit.cython_utils' as an importable package[^1], 2024-02-26T10:09:36,541 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,541 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,542 package, please make sure that 'moleculekit.cython_utils' is explicitly added 2024-02-26T10:09:36,542 to the `packages` configuration field. 2024-02-26T10:09:36,543 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,544 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,545 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,546 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,547 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,548 If you don't want 'moleculekit.cython_utils' to be distributed and are 2024-02-26T10:09:36,548 already explicitly excluding 'moleculekit.cython_utils' via 2024-02-26T10:09:36,549 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,549 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,550 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,551 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,552 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,553 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,554 even if it does not contain any `.py` files. 2024-02-26T10:09:36,554 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,555 directory, all directories are treated like packages. 2024-02-26T10:09:36,556 ******************************************************************************** 2024-02-26T10:09:36,556 !! 2024-02-26T10:09:36,557 check.warn(importable) 2024-02-26T10:09:36,557 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.distance_utils' is absent from the `packages` configuration. 2024-02-26T10:09:36,557 !! 2024-02-26T10:09:36,558 ******************************************************************************** 2024-02-26T10:09:36,558 ############################ 2024-02-26T10:09:36,559 # Package would be ignored # 2024-02-26T10:09:36,559 ############################ 2024-02-26T10:09:36,559 Python recognizes 'moleculekit.distance_utils' as an importable package[^1], 2024-02-26T10:09:36,560 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,561 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,561 package, please make sure that 'moleculekit.distance_utils' is explicitly added 2024-02-26T10:09:36,561 to the `packages` configuration field. 2024-02-26T10:09:36,562 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,562 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,563 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,564 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,565 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,566 If you don't want 'moleculekit.distance_utils' to be distributed and are 2024-02-26T10:09:36,566 already explicitly excluding 'moleculekit.distance_utils' via 2024-02-26T10:09:36,567 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,567 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,568 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,569 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,570 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,571 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,572 even if it does not contain any `.py` files. 2024-02-26T10:09:36,572 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,573 directory, all directories are treated like packages. 2024-02-26T10:09:36,573 ******************************************************************************** 2024-02-26T10:09:36,574 !! 2024-02-26T10:09:36,574 check.warn(importable) 2024-02-26T10:09:36,575 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos' is absent from the `packages` configuration. 2024-02-26T10:09:36,575 !! 2024-02-26T10:09:36,576 ******************************************************************************** 2024-02-26T10:09:36,577 ############################ 2024-02-26T10:09:36,577 # Package would be ignored # 2024-02-26T10:09:36,578 ############################ 2024-02-26T10:09:36,578 Python recognizes 'moleculekit.fileformats.binpos' as an importable package[^1], 2024-02-26T10:09:36,579 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,580 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,580 package, please make sure that 'moleculekit.fileformats.binpos' is explicitly added 2024-02-26T10:09:36,581 to the `packages` configuration field. 2024-02-26T10:09:36,582 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,582 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,582 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,583 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,584 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,584 If you don't want 'moleculekit.fileformats.binpos' to be distributed and are 2024-02-26T10:09:36,585 already explicitly excluding 'moleculekit.fileformats.binpos' via 2024-02-26T10:09:36,585 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,585 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,586 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,586 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,587 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,588 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,589 even if it does not contain any `.py` files. 2024-02-26T10:09:36,589 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,590 directory, all directories are treated like packages. 2024-02-26T10:09:36,590 ******************************************************************************** 2024-02-26T10:09:36,591 !! 2024-02-26T10:09:36,592 check.warn(importable) 2024-02-26T10:09:36,592 /tmp/pip-build-env-me8oktgj/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. 2024-02-26T10:09:36,593 !! 2024-02-26T10:09:36,594 ******************************************************************************** 2024-02-26T10:09:36,595 ############################ 2024-02-26T10:09:36,595 # Package would be ignored # 2024-02-26T10:09:36,596 ############################ 2024-02-26T10:09:36,597 Python recognizes 'moleculekit.fileformats.binpos.include' as an importable package[^1], 2024-02-26T10:09:36,597 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,598 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,599 package, please make sure that 'moleculekit.fileformats.binpos.include' is explicitly added 2024-02-26T10:09:36,599 to the `packages` configuration field. 2024-02-26T10:09:36,600 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,601 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,601 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,602 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,603 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,605 If you don't want 'moleculekit.fileformats.binpos.include' to be distributed and are 2024-02-26T10:09:36,605 already explicitly excluding 'moleculekit.fileformats.binpos.include' via 2024-02-26T10:09:36,606 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,606 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,607 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,608 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,609 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,610 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,610 even if it does not contain any `.py` files. 2024-02-26T10:09:36,610 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,611 directory, all directories are treated like packages. 2024-02-26T10:09:36,611 ******************************************************************************** 2024-02-26T10:09:36,612 !! 2024-02-26T10:09:36,612 check.warn(importable) 2024-02-26T10:09:36,612 /tmp/pip-build-env-me8oktgj/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. 2024-02-26T10:09:36,613 !! 2024-02-26T10:09:36,613 ******************************************************************************** 2024-02-26T10:09:36,614 ############################ 2024-02-26T10:09:36,614 # Package would be ignored # 2024-02-26T10:09:36,614 ############################ 2024-02-26T10:09:36,615 Python recognizes 'moleculekit.fileformats.binpos.src' as an importable package[^1], 2024-02-26T10:09:36,615 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,616 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,616 package, please make sure that 'moleculekit.fileformats.binpos.src' is explicitly added 2024-02-26T10:09:36,617 to the `packages` configuration field. 2024-02-26T10:09:36,618 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,618 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,619 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,620 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,621 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,622 If you don't want 'moleculekit.fileformats.binpos.src' to be distributed and are 2024-02-26T10:09:36,623 already explicitly excluding 'moleculekit.fileformats.binpos.src' via 2024-02-26T10:09:36,623 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,624 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,624 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,625 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,626 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,627 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,628 even if it does not contain any `.py` files. 2024-02-26T10:09:36,628 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,629 directory, all directories are treated like packages. 2024-02-26T10:09:36,629 ******************************************************************************** 2024-02-26T10:09:36,630 !! 2024-02-26T10:09:36,631 check.warn(importable) 2024-02-26T10:09:36,631 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd' is absent from the `packages` configuration. 2024-02-26T10:09:36,632 !! 2024-02-26T10:09:36,633 ******************************************************************************** 2024-02-26T10:09:36,634 ############################ 2024-02-26T10:09:36,634 # Package would be ignored # 2024-02-26T10:09:36,634 ############################ 2024-02-26T10:09:36,635 Python recognizes 'moleculekit.fileformats.dcd' as an importable package[^1], 2024-02-26T10:09:36,635 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,636 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,636 package, please make sure that 'moleculekit.fileformats.dcd' is explicitly added 2024-02-26T10:09:36,636 to the `packages` configuration field. 2024-02-26T10:09:36,637 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,637 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,638 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,638 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,639 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,640 If you don't want 'moleculekit.fileformats.dcd' to be distributed and are 2024-02-26T10:09:36,640 already explicitly excluding 'moleculekit.fileformats.dcd' via 2024-02-26T10:09:36,640 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,641 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,641 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,642 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,643 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,645 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,646 even if it does not contain any `.py` files. 2024-02-26T10:09:36,646 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,647 directory, all directories are treated like packages. 2024-02-26T10:09:36,647 ******************************************************************************** 2024-02-26T10:09:36,649 !! 2024-02-26T10:09:36,649 check.warn(importable) 2024-02-26T10:09:36,650 /tmp/pip-build-env-me8oktgj/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. 2024-02-26T10:09:36,650 !! 2024-02-26T10:09:36,651 ******************************************************************************** 2024-02-26T10:09:36,652 ############################ 2024-02-26T10:09:36,652 # Package would be ignored # 2024-02-26T10:09:36,653 ############################ 2024-02-26T10:09:36,653 Python recognizes 'moleculekit.fileformats.dcd.include' as an importable package[^1], 2024-02-26T10:09:36,654 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,655 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,655 package, please make sure that 'moleculekit.fileformats.dcd.include' is explicitly added 2024-02-26T10:09:36,656 to the `packages` configuration field. 2024-02-26T10:09:36,657 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,657 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,658 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,659 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,660 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,661 If you don't want 'moleculekit.fileformats.dcd.include' to be distributed and are 2024-02-26T10:09:36,662 already explicitly excluding 'moleculekit.fileformats.dcd.include' via 2024-02-26T10:09:36,662 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,662 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,663 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,664 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,665 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,666 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,666 even if it does not contain any `.py` files. 2024-02-26T10:09:36,667 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,667 directory, all directories are treated like packages. 2024-02-26T10:09:36,668 ******************************************************************************** 2024-02-26T10:09:36,669 !! 2024-02-26T10:09:36,669 check.warn(importable) 2024-02-26T10:09:36,670 /tmp/pip-build-env-me8oktgj/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. 2024-02-26T10:09:36,670 !! 2024-02-26T10:09:36,671 ******************************************************************************** 2024-02-26T10:09:36,672 ############################ 2024-02-26T10:09:36,673 # Package would be ignored # 2024-02-26T10:09:36,673 ############################ 2024-02-26T10:09:36,674 Python recognizes 'moleculekit.fileformats.dcd.src' as an importable package[^1], 2024-02-26T10:09:36,674 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,675 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,676 package, please make sure that 'moleculekit.fileformats.dcd.src' is explicitly added 2024-02-26T10:09:36,676 to the `packages` configuration field. 2024-02-26T10:09:36,677 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,678 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,679 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,680 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,681 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,682 If you don't want 'moleculekit.fileformats.dcd.src' to be distributed and are 2024-02-26T10:09:36,682 already explicitly excluding 'moleculekit.fileformats.dcd.src' via 2024-02-26T10:09:36,683 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,683 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,684 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,685 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,686 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,687 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,688 even if it does not contain any `.py` files. 2024-02-26T10:09:36,689 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,689 directory, all directories are treated like packages. 2024-02-26T10:09:36,690 ******************************************************************************** 2024-02-26T10:09:36,691 !! 2024-02-26T10:09:36,692 check.warn(importable) 2024-02-26T10:09:36,692 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc' is absent from the `packages` configuration. 2024-02-26T10:09:36,692 !! 2024-02-26T10:09:36,693 ******************************************************************************** 2024-02-26T10:09:36,694 ############################ 2024-02-26T10:09:36,694 # Package would be ignored # 2024-02-26T10:09:36,701 ############################ 2024-02-26T10:09:36,708 Python recognizes 'moleculekit.fileformats.xtc' as an importable package[^1], 2024-02-26T10:09:36,709 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,710 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,711 package, please make sure that 'moleculekit.fileformats.xtc' is explicitly added 2024-02-26T10:09:36,711 to the `packages` configuration field. 2024-02-26T10:09:36,712 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,712 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,713 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,714 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,715 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,716 If you don't want 'moleculekit.fileformats.xtc' to be distributed and are 2024-02-26T10:09:36,716 already explicitly excluding 'moleculekit.fileformats.xtc' via 2024-02-26T10:09:36,717 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,717 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,718 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,719 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,721 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,726 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,732 even if it does not contain any `.py` files. 2024-02-26T10:09:36,733 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,734 directory, all directories are treated like packages. 2024-02-26T10:09:36,734 ******************************************************************************** 2024-02-26T10:09:36,735 !! 2024-02-26T10:09:36,736 check.warn(importable) 2024-02-26T10:09:36,736 /tmp/pip-build-env-me8oktgj/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. 2024-02-26T10:09:36,737 !! 2024-02-26T10:09:36,738 ******************************************************************************** 2024-02-26T10:09:36,739 ############################ 2024-02-26T10:09:36,739 # Package would be ignored # 2024-02-26T10:09:36,740 ############################ 2024-02-26T10:09:36,740 Python recognizes 'moleculekit.fileformats.xtc.include' as an importable package[^1], 2024-02-26T10:09:36,741 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,744 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,745 package, please make sure that 'moleculekit.fileformats.xtc.include' is explicitly added 2024-02-26T10:09:36,745 to the `packages` configuration field. 2024-02-26T10:09:36,746 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,749 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,755 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,759 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,760 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,761 If you don't want 'moleculekit.fileformats.xtc.include' to be distributed and are 2024-02-26T10:09:36,761 already explicitly excluding 'moleculekit.fileformats.xtc.include' via 2024-02-26T10:09:36,762 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,762 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,763 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,763 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,764 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,766 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,766 even if it does not contain any `.py` files. 2024-02-26T10:09:36,767 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,767 directory, all directories are treated like packages. 2024-02-26T10:09:36,768 ******************************************************************************** 2024-02-26T10:09:36,769 !! 2024-02-26T10:09:36,770 check.warn(importable) 2024-02-26T10:09:36,772 /tmp/pip-build-env-me8oktgj/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. 2024-02-26T10:09:36,776 !! 2024-02-26T10:09:36,784 ******************************************************************************** 2024-02-26T10:09:36,784 ############################ 2024-02-26T10:09:36,785 # Package would be ignored # 2024-02-26T10:09:36,786 ############################ 2024-02-26T10:09:36,786 Python recognizes 'moleculekit.fileformats.xtc.src' as an importable package[^1], 2024-02-26T10:09:36,787 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,788 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,789 package, please make sure that 'moleculekit.fileformats.xtc.src' is explicitly added 2024-02-26T10:09:36,790 to the `packages` configuration field. 2024-02-26T10:09:36,806 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,807 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,807 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,808 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,809 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,811 If you don't want 'moleculekit.fileformats.xtc.src' to be distributed and are 2024-02-26T10:09:36,811 already explicitly excluding 'moleculekit.fileformats.xtc.src' via 2024-02-26T10:09:36,812 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,813 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,813 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,814 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,815 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,816 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,817 even if it does not contain any `.py` files. 2024-02-26T10:09:36,817 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,818 directory, all directories are treated like packages. 2024-02-26T10:09:36,818 ******************************************************************************** 2024-02-26T10:09:36,819 !! 2024-02-26T10:09:36,819 check.warn(importable) 2024-02-26T10:09:36,820 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.cationpi' is absent from the `packages` configuration. 2024-02-26T10:09:36,820 !! 2024-02-26T10:09:36,821 ******************************************************************************** 2024-02-26T10:09:36,822 ############################ 2024-02-26T10:09:36,822 # Package would be ignored # 2024-02-26T10:09:36,823 ############################ 2024-02-26T10:09:36,823 Python recognizes 'moleculekit.interactions.cationpi' as an importable package[^1], 2024-02-26T10:09:36,824 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,825 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,825 package, please make sure that 'moleculekit.interactions.cationpi' is explicitly added 2024-02-26T10:09:36,826 to the `packages` configuration field. 2024-02-26T10:09:36,827 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,827 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,828 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,829 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,830 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,832 If you don't want 'moleculekit.interactions.cationpi' to be distributed and are 2024-02-26T10:09:36,832 already explicitly excluding 'moleculekit.interactions.cationpi' via 2024-02-26T10:09:36,833 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,834 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,834 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,835 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,837 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,838 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,839 even if it does not contain any `.py` files. 2024-02-26T10:09:36,839 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,840 directory, all directories are treated like packages. 2024-02-26T10:09:36,841 ******************************************************************************** 2024-02-26T10:09:36,842 !! 2024-02-26T10:09:36,842 check.warn(importable) 2024-02-26T10:09:36,843 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.hbonds' is absent from the `packages` configuration. 2024-02-26T10:09:36,844 !! 2024-02-26T10:09:36,845 ******************************************************************************** 2024-02-26T10:09:36,846 ############################ 2024-02-26T10:09:36,846 # Package would be ignored # 2024-02-26T10:09:36,846 ############################ 2024-02-26T10:09:36,847 Python recognizes 'moleculekit.interactions.hbonds' as an importable package[^1], 2024-02-26T10:09:36,847 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,848 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,849 package, please make sure that 'moleculekit.interactions.hbonds' is explicitly added 2024-02-26T10:09:36,849 to the `packages` configuration field. 2024-02-26T10:09:36,850 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,850 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,851 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,852 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,853 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,853 If you don't want 'moleculekit.interactions.hbonds' to be distributed and are 2024-02-26T10:09:36,854 already explicitly excluding 'moleculekit.interactions.hbonds' via 2024-02-26T10:09:36,854 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,855 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,855 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:36,856 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:36,857 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:36,859 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:36,860 even if it does not contain any `.py` files. 2024-02-26T10:09:36,860 On the other hand, currently there is no concept of package data 2024-02-26T10:09:36,861 directory, all directories are treated like packages. 2024-02-26T10:09:36,862 ******************************************************************************** 2024-02-26T10:09:36,863 !! 2024-02-26T10:09:36,864 check.warn(importable) 2024-02-26T10:09:36,864 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.pipi' is absent from the `packages` configuration. 2024-02-26T10:09:36,865 !! 2024-02-26T10:09:36,866 ******************************************************************************** 2024-02-26T10:09:36,867 ############################ 2024-02-26T10:09:36,867 # Package would be ignored # 2024-02-26T10:09:36,868 ############################ 2024-02-26T10:09:36,868 Python recognizes 'moleculekit.interactions.pipi' as an importable package[^1], 2024-02-26T10:09:36,869 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:36,870 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:36,870 package, please make sure that 'moleculekit.interactions.pipi' is explicitly added 2024-02-26T10:09:36,871 to the `packages` configuration field. 2024-02-26T10:09:36,872 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:36,873 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:36,874 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:36,875 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:36,886 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:36,900 If you don't want 'moleculekit.interactions.pipi' to be distributed and are 2024-02-26T10:09:36,910 already explicitly excluding 'moleculekit.interactions.pipi' via 2024-02-26T10:09:36,927 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:36,949 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:36,969 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:37,005 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:37,006 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:37,007 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:37,007 even if it does not contain any `.py` files. 2024-02-26T10:09:37,008 On the other hand, currently there is no concept of package data 2024-02-26T10:09:37,008 directory, all directories are treated like packages. 2024-02-26T10:09:37,009 ******************************************************************************** 2024-02-26T10:09:37,009 !! 2024-02-26T10:09:37,010 check.warn(importable) 2024-02-26T10:09:37,010 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.sigmahole' is absent from the `packages` configuration. 2024-02-26T10:09:37,010 !! 2024-02-26T10:09:37,012 ******************************************************************************** 2024-02-26T10:09:37,012 ############################ 2024-02-26T10:09:37,013 # Package would be ignored # 2024-02-26T10:09:37,013 ############################ 2024-02-26T10:09:37,014 Python recognizes 'moleculekit.interactions.sigmahole' as an importable package[^1], 2024-02-26T10:09:37,014 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:37,015 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:37,016 package, please make sure that 'moleculekit.interactions.sigmahole' is explicitly added 2024-02-26T10:09:37,017 to the `packages` configuration field. 2024-02-26T10:09:37,018 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:37,018 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:37,019 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:37,020 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:37,021 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:37,023 If you don't want 'moleculekit.interactions.sigmahole' to be distributed and are 2024-02-26T10:09:37,023 already explicitly excluding 'moleculekit.interactions.sigmahole' via 2024-02-26T10:09:37,024 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:37,024 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:37,025 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:37,026 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:37,027 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:37,029 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:37,029 even if it does not contain any `.py` files. 2024-02-26T10:09:37,030 On the other hand, currently there is no concept of package data 2024-02-26T10:09:37,031 directory, all directories are treated like packages. 2024-02-26T10:09:37,031 ******************************************************************************** 2024-02-26T10:09:37,033 !! 2024-02-26T10:09:37,033 check.warn(importable) 2024-02-26T10:09:37,034 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.occupancy_utils' is absent from the `packages` configuration. 2024-02-26T10:09:37,034 !! 2024-02-26T10:09:37,035 ******************************************************************************** 2024-02-26T10:09:37,035 ############################ 2024-02-26T10:09:37,035 # Package would be ignored # 2024-02-26T10:09:37,036 ############################ 2024-02-26T10:09:37,036 Python recognizes 'moleculekit.occupancy_utils' as an importable package[^1], 2024-02-26T10:09:37,037 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:37,037 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:37,038 package, please make sure that 'moleculekit.occupancy_utils' is explicitly added 2024-02-26T10:09:37,038 to the `packages` configuration field. 2024-02-26T10:09:37,039 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:37,040 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:37,040 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:37,041 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:37,042 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:37,043 If you don't want 'moleculekit.occupancy_utils' to be distributed and are 2024-02-26T10:09:37,043 already explicitly excluding 'moleculekit.occupancy_utils' via 2024-02-26T10:09:37,044 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:37,044 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:37,045 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:37,045 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:37,046 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:37,048 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:37,048 even if it does not contain any `.py` files. 2024-02-26T10:09:37,049 On the other hand, currently there is no concept of package data 2024-02-26T10:09:37,049 directory, all directories are treated like packages. 2024-02-26T10:09:37,050 ******************************************************************************** 2024-02-26T10:09:37,051 !! 2024-02-26T10:09:37,051 check.warn(importable) 2024-02-26T10:09:37,052 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share' is absent from the `packages` configuration. 2024-02-26T10:09:37,052 !! 2024-02-26T10:09:37,053 ******************************************************************************** 2024-02-26T10:09:37,054 ############################ 2024-02-26T10:09:37,054 # Package would be ignored # 2024-02-26T10:09:37,055 ############################ 2024-02-26T10:09:37,055 Python recognizes 'moleculekit.share' as an importable package[^1], 2024-02-26T10:09:37,056 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:37,057 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:37,057 package, please make sure that 'moleculekit.share' is explicitly added 2024-02-26T10:09:37,058 to the `packages` configuration field. 2024-02-26T10:09:37,059 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:37,059 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:37,059 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:37,060 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:37,061 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:37,062 If you don't want 'moleculekit.share' to be distributed and are 2024-02-26T10:09:37,062 already explicitly excluding 'moleculekit.share' via 2024-02-26T10:09:37,063 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:37,063 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:37,064 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:37,064 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:37,065 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:37,066 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:37,067 even if it does not contain any `.py` files. 2024-02-26T10:09:37,067 On the other hand, currently there is no concept of package data 2024-02-26T10:09:37,068 directory, all directories are treated like packages. 2024-02-26T10:09:37,068 ******************************************************************************** 2024-02-26T10:09:37,069 !! 2024-02-26T10:09:37,070 check.warn(importable) 2024-02-26T10:09:37,070 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share.atomselect' is absent from the `packages` configuration. 2024-02-26T10:09:37,071 !! 2024-02-26T10:09:37,072 ******************************************************************************** 2024-02-26T10:09:37,072 ############################ 2024-02-26T10:09:37,073 # Package would be ignored # 2024-02-26T10:09:37,073 ############################ 2024-02-26T10:09:37,074 Python recognizes 'moleculekit.share.atomselect' as an importable package[^1], 2024-02-26T10:09:37,074 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:37,075 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:37,076 package, please make sure that 'moleculekit.share.atomselect' is explicitly added 2024-02-26T10:09:37,076 to the `packages` configuration field. 2024-02-26T10:09:37,077 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:37,078 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:37,078 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:37,079 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:37,080 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:37,081 If you don't want 'moleculekit.share.atomselect' to be distributed and are 2024-02-26T10:09:37,082 already explicitly excluding 'moleculekit.share.atomselect' via 2024-02-26T10:09:37,082 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:37,083 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:37,083 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:37,085 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:37,085 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:37,087 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:37,087 even if it does not contain any `.py` files. 2024-02-26T10:09:37,087 On the other hand, currently there is no concept of package data 2024-02-26T10:09:37,088 directory, all directories are treated like packages. 2024-02-26T10:09:37,088 ******************************************************************************** 2024-02-26T10:09:37,089 !! 2024-02-26T10:09:37,089 check.warn(importable) 2024-02-26T10:09:37,090 /tmp/pip-build-env-me8oktgj/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. 2024-02-26T10:09:37,090 !! 2024-02-26T10:09:37,091 ******************************************************************************** 2024-02-26T10:09:37,091 ############################ 2024-02-26T10:09:37,092 # Package would be ignored # 2024-02-26T10:09:37,092 ############################ 2024-02-26T10:09:37,093 Python recognizes 'moleculekit.share.pdb2pqr.residues' as an importable package[^1], 2024-02-26T10:09:37,093 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:37,094 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:37,094 package, please make sure that 'moleculekit.share.pdb2pqr.residues' is explicitly added 2024-02-26T10:09:37,095 to the `packages` configuration field. 2024-02-26T10:09:37,096 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:37,096 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:37,097 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:37,098 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:37,099 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:37,099 If you don't want 'moleculekit.share.pdb2pqr.residues' to be distributed and are 2024-02-26T10:09:37,100 already explicitly excluding 'moleculekit.share.pdb2pqr.residues' via 2024-02-26T10:09:37,100 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:37,101 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:37,101 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:37,102 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:37,103 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:37,105 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:37,105 even if it does not contain any `.py` files. 2024-02-26T10:09:37,106 On the other hand, currently there is no concept of package data 2024-02-26T10:09:37,106 directory, all directories are treated like packages. 2024-02-26T10:09:37,107 ******************************************************************************** 2024-02-26T10:09:37,108 !! 2024-02-26T10:09:37,108 check.warn(importable) 2024-02-26T10:09:37,109 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign' is absent from the `packages` configuration. 2024-02-26T10:09:37,109 !! 2024-02-26T10:09:37,110 ******************************************************************************** 2024-02-26T10:09:37,111 ############################ 2024-02-26T10:09:37,111 # Package would be ignored # 2024-02-26T10:09:37,112 ############################ 2024-02-26T10:09:37,112 Python recognizes 'moleculekit.tmalign' as an importable package[^1], 2024-02-26T10:09:37,113 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:37,113 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:37,114 package, please make sure that 'moleculekit.tmalign' is explicitly added 2024-02-26T10:09:37,114 to the `packages` configuration field. 2024-02-26T10:09:37,115 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:37,115 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:37,116 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:37,117 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:37,117 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:37,118 If you don't want 'moleculekit.tmalign' to be distributed and are 2024-02-26T10:09:37,119 already explicitly excluding 'moleculekit.tmalign' via 2024-02-26T10:09:37,119 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:37,119 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:37,120 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:37,121 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:37,122 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:37,123 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:37,124 even if it does not contain any `.py` files. 2024-02-26T10:09:37,124 On the other hand, currently there is no concept of package data 2024-02-26T10:09:37,124 directory, all directories are treated like packages. 2024-02-26T10:09:37,125 ******************************************************************************** 2024-02-26T10:09:37,126 !! 2024-02-26T10:09:37,126 check.warn(importable) 2024-02-26T10:09:37,127 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.include' is absent from the `packages` configuration. 2024-02-26T10:09:37,127 !! 2024-02-26T10:09:37,128 ******************************************************************************** 2024-02-26T10:09:37,129 ############################ 2024-02-26T10:09:37,129 # Package would be ignored # 2024-02-26T10:09:37,130 ############################ 2024-02-26T10:09:37,130 Python recognizes 'moleculekit.tmalign.include' as an importable package[^1], 2024-02-26T10:09:37,131 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:37,132 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:37,132 package, please make sure that 'moleculekit.tmalign.include' is explicitly added 2024-02-26T10:09:37,133 to the `packages` configuration field. 2024-02-26T10:09:37,134 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:37,134 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:37,135 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:37,136 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:37,137 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:37,138 If you don't want 'moleculekit.tmalign.include' to be distributed and are 2024-02-26T10:09:37,138 already explicitly excluding 'moleculekit.tmalign.include' via 2024-02-26T10:09:37,139 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:37,139 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:37,140 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:37,141 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:37,141 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:37,143 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:37,143 even if it does not contain any `.py` files. 2024-02-26T10:09:37,144 On the other hand, currently there is no concept of package data 2024-02-26T10:09:37,144 directory, all directories are treated like packages. 2024-02-26T10:09:37,144 ******************************************************************************** 2024-02-26T10:09:37,145 !! 2024-02-26T10:09:37,146 check.warn(importable) 2024-02-26T10:09:37,146 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.src' is absent from the `packages` configuration. 2024-02-26T10:09:37,147 !! 2024-02-26T10:09:37,148 ******************************************************************************** 2024-02-26T10:09:37,148 ############################ 2024-02-26T10:09:37,149 # Package would be ignored # 2024-02-26T10:09:37,149 ############################ 2024-02-26T10:09:37,150 Python recognizes 'moleculekit.tmalign.src' as an importable package[^1], 2024-02-26T10:09:37,150 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:37,151 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:37,152 package, please make sure that 'moleculekit.tmalign.src' is explicitly added 2024-02-26T10:09:37,152 to the `packages` configuration field. 2024-02-26T10:09:37,153 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:37,154 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:37,154 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:37,155 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:37,156 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:37,157 If you don't want 'moleculekit.tmalign.src' to be distributed and are 2024-02-26T10:09:37,159 already explicitly excluding 'moleculekit.tmalign.src' via 2024-02-26T10:09:37,160 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:37,161 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:37,161 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:37,162 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:37,164 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:37,165 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:37,166 even if it does not contain any `.py` files. 2024-02-26T10:09:37,166 On the other hand, currently there is no concept of package data 2024-02-26T10:09:37,167 directory, all directories are treated like packages. 2024-02-26T10:09:37,168 ******************************************************************************** 2024-02-26T10:09:37,169 !! 2024-02-26T10:09:37,170 check.warn(importable) 2024-02-26T10:09:37,170 /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.wrapping' is absent from the `packages` configuration. 2024-02-26T10:09:37,171 !! 2024-02-26T10:09:37,172 ******************************************************************************** 2024-02-26T10:09:37,173 ############################ 2024-02-26T10:09:37,173 # Package would be ignored # 2024-02-26T10:09:37,174 ############################ 2024-02-26T10:09:37,174 Python recognizes 'moleculekit.wrapping' as an importable package[^1], 2024-02-26T10:09:37,175 but it is absent from setuptools' `packages` configuration. 2024-02-26T10:09:37,176 This leads to an ambiguous overall configuration. If you want to distribute this 2024-02-26T10:09:37,176 package, please make sure that 'moleculekit.wrapping' is explicitly added 2024-02-26T10:09:37,177 to the `packages` configuration field. 2024-02-26T10:09:37,178 Alternatively, you can also rely on setuptools' discovery methods 2024-02-26T10:09:37,178 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-02-26T10:09:37,179 instead of `find_packages(...)`/`find:`). 2024-02-26T10:09:37,180 You can read more about "package discovery" on setuptools documentation page: 2024-02-26T10:09:37,181 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-02-26T10:09:37,183 If you don't want 'moleculekit.wrapping' to be distributed and are 2024-02-26T10:09:37,183 already explicitly excluding 'moleculekit.wrapping' via 2024-02-26T10:09:37,184 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-02-26T10:09:37,184 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-02-26T10:09:37,185 combination with a more fine grained `package-data` configuration. 2024-02-26T10:09:37,186 You can read more about "package data files" on setuptools documentation page: 2024-02-26T10:09:37,187 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-02-26T10:09:37,189 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-02-26T10:09:37,190 even if it does not contain any `.py` files. 2024-02-26T10:09:37,190 On the other hand, currently there is no concept of package data 2024-02-26T10:09:37,191 directory, all directories are treated like packages. 2024-02-26T10:09:37,191 ******************************************************************************** 2024-02-26T10:09:37,192 !! 2024-02-26T10:09:37,193 check.warn(importable) 2024-02-26T10:09:37,193 copying moleculekit/logging.ini -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:37,194 copying moleculekit/vmd_wrapper -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:37,194 creating build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-02-26T10:09:37,195 copying moleculekit/atomselect_utils/atomselect_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-02-26T10:09:37,195 copying moleculekit/atomselect_utils/atomselect_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-02-26T10:09:37,196 creating build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-02-26T10:09:37,196 copying moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-02-26T10:09:37,197 copying moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-02-26T10:09:37,197 creating build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-02-26T10:09:37,198 copying moleculekit/cython_utils/cython_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-02-26T10:09:37,199 copying moleculekit/cython_utils/cython_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-02-26T10:09:37,199 creating build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-02-26T10:09:37,200 copying moleculekit/distance_utils/distance_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-02-26T10:09:37,200 copying moleculekit/distance_utils/distance_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-02-26T10:09:37,201 creating build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-02-26T10:09:37,201 copying moleculekit/occupancy_utils/occupancy_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-02-26T10:09:37,202 copying moleculekit/occupancy_utils/occupancy_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-02-26T10:09:37,203 creating build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-02-26T10:09:37,203 copying moleculekit/share/ALA.cif -> build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-02-26T10:09:37,203 copying moleculekit/share/backbone.cif -> build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-02-26T10:09:37,204 copying moleculekit/share/opm_sequences.json -> build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-02-26T10:09:37,204 creating build/lib.linux-armv7l-cpython-311/moleculekit/share/atomselect 2024-02-26T10:09:37,205 copying moleculekit/share/atomselect/atomselect.json -> build/lib.linux-armv7l-cpython-311/moleculekit/share/atomselect 2024-02-26T10:09:37,205 creating build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr 2024-02-26T10:09:37,206 creating build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,206 copying moleculekit/share/pdb2pqr/residues/.gitkeep -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,207 copying moleculekit/share/pdb2pqr/residues/004.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,207 copying moleculekit/share/pdb2pqr/residues/004.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,208 copying moleculekit/share/pdb2pqr/residues/03Y.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,208 copying moleculekit/share/pdb2pqr/residues/03Y.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,209 copying moleculekit/share/pdb2pqr/residues/0A1.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,209 copying moleculekit/share/pdb2pqr/residues/0A1.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,210 copying moleculekit/share/pdb2pqr/residues/0AF.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,210 copying moleculekit/share/pdb2pqr/residues/0AF.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,211 copying moleculekit/share/pdb2pqr/residues/0BN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,211 copying moleculekit/share/pdb2pqr/residues/0BN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,212 copying moleculekit/share/pdb2pqr/residues/1MH.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,213 copying moleculekit/share/pdb2pqr/residues/1MH.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,213 copying moleculekit/share/pdb2pqr/residues/2AS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,214 copying moleculekit/share/pdb2pqr/residues/2AS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,214 copying moleculekit/share/pdb2pqr/residues/2GX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,215 copying moleculekit/share/pdb2pqr/residues/2GX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,216 copying moleculekit/share/pdb2pqr/residues/2ML.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,216 copying moleculekit/share/pdb2pqr/residues/2ML.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,217 copying moleculekit/share/pdb2pqr/residues/2MR.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,217 copying moleculekit/share/pdb2pqr/residues/2MR.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,218 copying moleculekit/share/pdb2pqr/residues/4IN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,218 copying moleculekit/share/pdb2pqr/residues/4IN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,219 copying moleculekit/share/pdb2pqr/residues/4PH.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,220 copying moleculekit/share/pdb2pqr/residues/4PH.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,220 copying moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,221 copying moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,222 copying moleculekit/share/pdb2pqr/residues/5JP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,222 copying moleculekit/share/pdb2pqr/residues/5JP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,223 copying moleculekit/share/pdb2pqr/residues/AA4.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,224 copying moleculekit/share/pdb2pqr/residues/AA4.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,224 copying moleculekit/share/pdb2pqr/residues/ABA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,225 copying moleculekit/share/pdb2pqr/residues/ABA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,225 copying moleculekit/share/pdb2pqr/residues/AHP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,226 copying moleculekit/share/pdb2pqr/residues/AHP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,226 copying moleculekit/share/pdb2pqr/residues/ALC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,227 copying moleculekit/share/pdb2pqr/residues/ALC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,228 copying moleculekit/share/pdb2pqr/residues/ALN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,228 copying moleculekit/share/pdb2pqr/residues/ALN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,229 copying moleculekit/share/pdb2pqr/residues/ALY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,229 copying moleculekit/share/pdb2pqr/residues/ALY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,230 copying moleculekit/share/pdb2pqr/residues/APD.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,230 copying moleculekit/share/pdb2pqr/residues/APD.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,231 copying moleculekit/share/pdb2pqr/residues/BB8.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,232 copying moleculekit/share/pdb2pqr/residues/BB8.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,232 copying moleculekit/share/pdb2pqr/residues/BCS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,233 copying moleculekit/share/pdb2pqr/residues/BCS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,233 copying moleculekit/share/pdb2pqr/residues/BTK.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,234 copying moleculekit/share/pdb2pqr/residues/BTK.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,234 copying moleculekit/share/pdb2pqr/residues/CCS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,234 copying moleculekit/share/pdb2pqr/residues/CCS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,235 copying moleculekit/share/pdb2pqr/residues/CGU.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,235 copying moleculekit/share/pdb2pqr/residues/CGU.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,236 copying moleculekit/share/pdb2pqr/residues/CSA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,236 copying moleculekit/share/pdb2pqr/residues/CSA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,237 copying moleculekit/share/pdb2pqr/residues/CSO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,237 copying moleculekit/share/pdb2pqr/residues/CSO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,238 copying moleculekit/share/pdb2pqr/residues/CSP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,238 copying moleculekit/share/pdb2pqr/residues/CSP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,239 copying moleculekit/share/pdb2pqr/residues/CSS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,239 copying moleculekit/share/pdb2pqr/residues/CSS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,240 copying moleculekit/share/pdb2pqr/residues/D4P.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,240 copying moleculekit/share/pdb2pqr/residues/D4P.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,241 copying moleculekit/share/pdb2pqr/residues/DA2.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,241 copying moleculekit/share/pdb2pqr/residues/DA2.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,242 copying moleculekit/share/pdb2pqr/residues/DAB.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,242 copying moleculekit/share/pdb2pqr/residues/DAB.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,243 copying moleculekit/share/pdb2pqr/residues/DAH.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,244 copying moleculekit/share/pdb2pqr/residues/DAH.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,244 copying moleculekit/share/pdb2pqr/residues/DPP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,245 copying moleculekit/share/pdb2pqr/residues/DPP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,245 copying moleculekit/share/pdb2pqr/residues/ESC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,246 copying moleculekit/share/pdb2pqr/residues/ESC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,246 copying moleculekit/share/pdb2pqr/residues/FGL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,247 copying moleculekit/share/pdb2pqr/residues/FGL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,247 copying moleculekit/share/pdb2pqr/residues/GHG.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,247 copying moleculekit/share/pdb2pqr/residues/GHG.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,248 copying moleculekit/share/pdb2pqr/residues/GME.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,248 copying moleculekit/share/pdb2pqr/residues/GME.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,249 copying moleculekit/share/pdb2pqr/residues/GNC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,249 copying moleculekit/share/pdb2pqr/residues/GNC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,250 copying moleculekit/share/pdb2pqr/residues/HHK.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,250 copying moleculekit/share/pdb2pqr/residues/HHK.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,251 copying moleculekit/share/pdb2pqr/residues/HLU.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,251 copying moleculekit/share/pdb2pqr/residues/HLU.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,252 copying moleculekit/share/pdb2pqr/residues/HLX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,252 copying moleculekit/share/pdb2pqr/residues/HLX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,253 copying moleculekit/share/pdb2pqr/residues/HOX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,253 copying moleculekit/share/pdb2pqr/residues/HOX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,254 copying moleculekit/share/pdb2pqr/residues/HPE.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,254 copying moleculekit/share/pdb2pqr/residues/HPE.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,255 copying moleculekit/share/pdb2pqr/residues/HQA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,256 copying moleculekit/share/pdb2pqr/residues/HQA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,256 copying moleculekit/share/pdb2pqr/residues/HTR.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,258 copying moleculekit/share/pdb2pqr/residues/HTR.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,260 copying moleculekit/share/pdb2pqr/residues/HYP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,262 copying moleculekit/share/pdb2pqr/residues/HYP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,264 copying moleculekit/share/pdb2pqr/residues/I2M.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,266 copying moleculekit/share/pdb2pqr/residues/I2M.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,268 copying moleculekit/share/pdb2pqr/residues/IGL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,270 copying moleculekit/share/pdb2pqr/residues/IGL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,272 copying moleculekit/share/pdb2pqr/residues/IIL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,274 copying moleculekit/share/pdb2pqr/residues/IIL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,276 copying moleculekit/share/pdb2pqr/residues/IML.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,278 copying moleculekit/share/pdb2pqr/residues/IML.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,280 copying moleculekit/share/pdb2pqr/residues/KYN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,282 copying moleculekit/share/pdb2pqr/residues/KYN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,284 copying moleculekit/share/pdb2pqr/residues/LME.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,286 copying moleculekit/share/pdb2pqr/residues/LME.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,288 copying moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,290 copying moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,292 copying moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,294 copying moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,296 copying moleculekit/share/pdb2pqr/residues/M3L.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,298 copying moleculekit/share/pdb2pqr/residues/M3L.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,301 copying moleculekit/share/pdb2pqr/residues/ME0.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,303 copying moleculekit/share/pdb2pqr/residues/ME0.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,305 copying moleculekit/share/pdb2pqr/residues/MEA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,307 copying moleculekit/share/pdb2pqr/residues/MEA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,309 copying moleculekit/share/pdb2pqr/residues/MEN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,311 copying moleculekit/share/pdb2pqr/residues/MEN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,313 copying moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,315 copying moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,317 copying moleculekit/share/pdb2pqr/residues/MLE.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,319 copying moleculekit/share/pdb2pqr/residues/MLE.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,321 copying moleculekit/share/pdb2pqr/residues/MLY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,323 copying moleculekit/share/pdb2pqr/residues/MLY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,325 copying moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,327 copying moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,329 copying moleculekit/share/pdb2pqr/residues/MME.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,331 copying moleculekit/share/pdb2pqr/residues/MME.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,334 copying moleculekit/share/pdb2pqr/residues/MMO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,336 copying moleculekit/share/pdb2pqr/residues/MMO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,338 copying moleculekit/share/pdb2pqr/residues/MVA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,339 copying moleculekit/share/pdb2pqr/residues/MVA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,341 copying moleculekit/share/pdb2pqr/residues/NAL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,343 copying moleculekit/share/pdb2pqr/residues/NAL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,346 copying moleculekit/share/pdb2pqr/residues/NCY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,348 copying moleculekit/share/pdb2pqr/residues/NCY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,350 copying moleculekit/share/pdb2pqr/residues/NLE.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,352 copying moleculekit/share/pdb2pqr/residues/NLE.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,354 copying moleculekit/share/pdb2pqr/residues/NVA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,356 copying moleculekit/share/pdb2pqr/residues/NVA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,358 copying moleculekit/share/pdb2pqr/residues/NZC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,360 copying moleculekit/share/pdb2pqr/residues/NZC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,362 copying moleculekit/share/pdb2pqr/residues/OCY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,364 copying moleculekit/share/pdb2pqr/residues/OCY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,367 copying moleculekit/share/pdb2pqr/residues/OMX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,369 copying moleculekit/share/pdb2pqr/residues/OMX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,371 copying moleculekit/share/pdb2pqr/residues/ONL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,373 copying moleculekit/share/pdb2pqr/residues/ONL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,375 copying moleculekit/share/pdb2pqr/residues/ORM.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,377 copying moleculekit/share/pdb2pqr/residues/ORM.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,379 copying moleculekit/share/pdb2pqr/residues/P1L.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,381 copying moleculekit/share/pdb2pqr/residues/P1L.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,383 copying moleculekit/share/pdb2pqr/residues/PCA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,385 copying moleculekit/share/pdb2pqr/residues/PCA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,387 copying moleculekit/share/pdb2pqr/residues/PRK.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,389 copying moleculekit/share/pdb2pqr/residues/PRK.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,391 copying moleculekit/share/pdb2pqr/residues/PTR.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,393 copying moleculekit/share/pdb2pqr/residues/PTR.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,395 copying moleculekit/share/pdb2pqr/residues/SEP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,397 copying moleculekit/share/pdb2pqr/residues/SEP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,399 copying moleculekit/share/pdb2pqr/residues/TPO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,401 copying moleculekit/share/pdb2pqr/residues/TPO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,403 copying moleculekit/share/pdb2pqr/residues/TRO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,405 copying moleculekit/share/pdb2pqr/residues/TRO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,407 copying moleculekit/share/pdb2pqr/residues/TY2.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,409 copying moleculekit/share/pdb2pqr/residues/TY2.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,411 copying moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,414 copying moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,416 copying moleculekit/share/pdb2pqr/residues/YCM.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,418 copying moleculekit/share/pdb2pqr/residues/YCM.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,420 copying moleculekit/share/pdb2pqr/residues/YNM.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,422 copying moleculekit/share/pdb2pqr/residues/YNM.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-02-26T10:09:37,424 creating build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-02-26T10:09:37,425 copying moleculekit/tmalign/tmalign_util.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-02-26T10:09:37,444 copying moleculekit/tmalign/tmalign_util.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-02-26T10:09:37,447 copying moleculekit/tmalign/tmalignlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-02-26T10:09:37,448 creating build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/include 2024-02-26T10:09:37,450 copying moleculekit/tmalign/include/TMAlign.h -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/include 2024-02-26T10:09:37,452 creating build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/src 2024-02-26T10:09:37,453 copying moleculekit/tmalign/src/TMAlign.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/src 2024-02-26T10:09:37,458 creating build/lib.linux-armv7l-cpython-311/moleculekit/wrapping 2024-02-26T10:09:37,460 copying moleculekit/wrapping/wrapping.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/wrapping 2024-02-26T10:09:37,481 copying moleculekit/wrapping/wrapping.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/wrapping 2024-02-26T10:09:37,483 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-02-26T10:09:37,484 copying moleculekit/fileformats/binpos/binpos.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-02-26T10:09:37,499 copying moleculekit/fileformats/binpos/binpos.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-02-26T10:09:37,502 copying moleculekit/fileformats/binpos/binposlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-02-26T10:09:37,504 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-02-26T10:09:37,505 copying moleculekit/fileformats/binpos/include/binposplugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-02-26T10:09:37,507 copying moleculekit/fileformats/binpos/include/largefiles.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-02-26T10:09:37,509 copying moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-02-26T10:09:37,513 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src 2024-02-26T10:09:37,514 copying moleculekit/fileformats/binpos/src/binposplugin.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src 2024-02-26T10:09:37,516 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-02-26T10:09:37,518 copying moleculekit/fileformats/dcd/dcd.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-02-26T10:09:37,536 copying moleculekit/fileformats/dcd/dcd.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-02-26T10:09:37,539 copying moleculekit/fileformats/dcd/dcdlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-02-26T10:09:37,541 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-02-26T10:09:37,542 copying moleculekit/fileformats/dcd/include/dcdplugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-02-26T10:09:37,545 copying moleculekit/fileformats/dcd/include/endianswap.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-02-26T10:09:37,548 copying moleculekit/fileformats/dcd/include/fastio.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-02-26T10:09:37,551 copying moleculekit/fileformats/dcd/include/largefiles.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-02-26T10:09:37,553 copying moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-02-26T10:09:37,556 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src 2024-02-26T10:09:37,557 copying moleculekit/fileformats/dcd/src/dcdplugin.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src 2024-02-26T10:09:37,561 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-02-26T10:09:37,562 copying moleculekit/fileformats/xtc/trr.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-02-26T10:09:37,592 copying moleculekit/fileformats/xtc/trr.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-02-26T10:09:37,595 copying moleculekit/fileformats/xtc/trrlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-02-26T10:09:37,597 copying moleculekit/fileformats/xtc/xdrlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-02-26T10:09:37,598 copying moleculekit/fileformats/xtc/xtc.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-02-26T10:09:37,620 copying moleculekit/fileformats/xtc/xtc.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-02-26T10:09:37,622 copying moleculekit/fileformats/xtc/xtclib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-02-26T10:09:37,624 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-02-26T10:09:37,625 copying moleculekit/fileformats/xtc/include/trr_header.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-02-26T10:09:37,627 copying moleculekit/fileformats/xtc/include/xdr_seek.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-02-26T10:09:37,629 copying moleculekit/fileformats/xtc/include/xdrfile.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-02-26T10:09:37,631 copying moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-02-26T10:09:37,633 copying moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-02-26T10:09:37,635 copying moleculekit/fileformats/xtc/include/xtc.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-02-26T10:09:37,637 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-02-26T10:09:37,638 copying moleculekit/fileformats/xtc/src/xdr_seek.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-02-26T10:09:37,640 copying moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-02-26T10:09:37,643 copying moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-02-26T10:09:37,646 copying moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-02-26T10:09:37,648 copying moleculekit/fileformats/xtc/src/xtc.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-02-26T10:09:37,651 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-02-26T10:09:37,652 copying moleculekit/interactions/cationpi/cationpi.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-02-26T10:09:37,672 copying moleculekit/interactions/cationpi/cationpi.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-02-26T10:09:37,675 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-02-26T10:09:37,676 copying moleculekit/interactions/hbonds/hbonds.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-02-26T10:09:37,702 copying moleculekit/interactions/hbonds/hbonds.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-02-26T10:09:37,704 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-02-26T10:09:37,705 copying moleculekit/interactions/pipi/pipi.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-02-26T10:09:37,727 copying moleculekit/interactions/pipi/pipi.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-02-26T10:09:37,729 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-02-26T10:09:37,730 copying moleculekit/interactions/sigmahole/sigmahole.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-02-26T10:09:37,752 copying moleculekit/interactions/sigmahole/sigmahole.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-02-26T10:09:37,762 UPDATING build/lib.linux-armv7l-cpython-311/moleculekit/_version.py 2024-02-26T10:09:37,763 set build/lib.linux-armv7l-cpython-311/moleculekit/_version.py to '1.8.24' 2024-02-26T10:09:37,763 running build_ext 2024-02-26T10:09:37,772 building 'moleculekit.interactions.hbonds' extension 2024-02-26T10:09:37,773 creating build/temp.linux-armv7l-cpython-311 2024-02-26T10:09:37,773 creating build/temp.linux-armv7l-cpython-311/moleculekit 2024-02-26T10:09:37,774 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions 2024-02-26T10:09:37,775 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-02-26T10:09:37,776 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-me8oktgj/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 2024-02-26T10:09:38,098 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:09:38,099 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:09:38,099 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:09:38,100 from moleculekit/interactions/hbonds/hbonds.cpp:1230: 2024-02-26T10:09:38,100 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:09:38,101 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:09:38,101 | ^~~~~~~ 2024-02-26T10:10:05,604 In function ‘PyObject* __pyx_pf_11moleculekit_12interactions_6hbonds_calculate(PyObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, float, float, bool, bool)’, 2024-02-26T10:10:05,605 inlined from ‘PyObject* __pyx_pw_11moleculekit_12interactions_6hbonds_1calculate(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/interactions/hbonds/hbonds.cpp:19971:68: 2024-02-26T10:10:05,606 moleculekit/interactions/hbonds/hbonds.cpp:21001:52: warning: ‘__pyx_v_d_idx_h’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:10:05,606 21001 | (__pyx_v_results[__pyx_v_f]).push_back(__pyx_v_d_idx_h); 2024-02-26T10:10:05,607 | ^~~~~~~~~~~~~~~ 2024-02-26T10:10:05,608 moleculekit/interactions/hbonds/hbonds.cpp: In function ‘PyObject* __pyx_pw_11moleculekit_12interactions_6hbonds_1calculate(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-02-26T10:10:05,609 moleculekit/interactions/hbonds/hbonds.cpp:20014:57: note: ‘__pyx_v_d_idx_h’ was declared here 2024-02-26T10:10:05,609 20014 | __pyx_t_11moleculekit_12interactions_6hbonds_UINT32_t __pyx_v_d_idx_h; 2024-02-26T10:10:05,610 | ^~~~~~~~~~~~~~~ 2024-02-26T10:10:08,616 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 2024-02-26T10:10:08,898 building 'moleculekit.interactions.pipi' extension 2024-02-26T10:10:08,899 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-02-26T10:10:08,899 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-me8oktgj/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 2024-02-26T10:10:09,202 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:10:09,202 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:10:09,203 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:10:09,203 from moleculekit/interactions/pipi/pipi.cpp:1230: 2024-02-26T10:10:09,204 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:10:09,204 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:10:09,205 | ^~~~~~~ 2024-02-26T10:10:42,200 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 2024-02-26T10:10:42,480 building 'moleculekit.interactions.cationpi' extension 2024-02-26T10:10:42,481 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-02-26T10:10:42,482 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-me8oktgj/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 2024-02-26T10:10:42,798 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:10:42,798 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:10:42,799 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:10:42,800 from moleculekit/interactions/cationpi/cationpi.cpp:1230: 2024-02-26T10:10:42,800 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:10:42,805 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:10:42,805 | ^~~~~~~ 2024-02-26T10:11:15,083 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 2024-02-26T10:11:15,370 building 'moleculekit.interactions.sigmahole' extension 2024-02-26T10:11:15,370 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-02-26T10:11:15,371 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-me8oktgj/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 2024-02-26T10:11:15,682 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:11:15,683 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:11:15,683 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:11:15,684 from moleculekit/interactions/sigmahole/sigmahole.cpp:1230: 2024-02-26T10:11:15,684 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:11:15,685 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:11:15,685 | ^~~~~~~ 2024-02-26T10:11:47,598 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 2024-02-26T10:11:47,884 building 'moleculekit.wrapping' extension 2024-02-26T10:11:47,885 creating build/temp.linux-armv7l-cpython-311/moleculekit/wrapping 2024-02-26T10:11:47,886 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-me8oktgj/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 2024-02-26T10:11:48,196 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:11:48,197 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:11:48,197 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:11:48,198 from moleculekit/wrapping/wrapping.cpp:1230: 2024-02-26T10:11:48,199 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:11:48,199 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:11:48,200 | ^~~~~~~ 2024-02-26T10:12:18,575 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 2024-02-26T10:12:18,765 building 'moleculekit.bondguesser_utils' extension 2024-02-26T10:12:18,766 creating build/temp.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-02-26T10:12:18,766 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-me8oktgj/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 2024-02-26T10:12:19,071 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:12:19,072 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:12:19,072 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:12:19,073 from moleculekit/bondguesser_utils/bondguesser_utils.cpp:1230: 2024-02-26T10:12:19,073 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:12:19,073 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:12:19,074 | ^~~~~~~ 2024-02-26T10:12:21,407 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)’: 2024-02-26T10:12:21,408 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19783:33: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-02-26T10:12:21,409 19783 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-02-26T10:12:21,409 | ~~~~~~~~~~^~~~~~~~~~~ 2024-02-26T10:12:21,410 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19795:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-02-26T10:12:21,410 19795 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-02-26T10:12:21,411 | ~~~~~~~~~~^~~~~~~~~~~ 2024-02-26T10:12:21,411 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19807:37: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-02-26T10:12:21,412 19807 | for (__pyx_t_9 = 0; __pyx_t_9 < __pyx_t_8; __pyx_t_9+=1) { 2024-02-26T10:12:21,413 | ~~~~~~~~~~^~~~~~~~~~~ 2024-02-26T10:12:21,413 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19846:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,414 19846 | __pyx_t_12 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-02-26T10:12:21,415 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,416 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19885:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,416 19885 | __pyx_t_12 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-02-26T10:12:21,417 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,417 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19924:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,418 19924 | __pyx_t_12 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-02-26T10:12:21,419 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,419 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19963:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,420 19963 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-02-26T10:12:21,421 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,422 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19969:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,422 19969 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-02-26T10:12:21,423 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,423 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20010:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,424 20010 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-02-26T10:12:21,424 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,425 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20016:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,425 20016 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-02-26T10:12:21,426 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,426 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20057:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,427 20057 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-02-26T10:12:21,427 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,428 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20063:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,429 20063 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-02-26T10:12:21,429 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,430 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20104:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,431 20104 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-02-26T10:12:21,431 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,432 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20157:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,433 20157 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-02-26T10:12:21,434 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,434 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20204:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,435 20204 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-02-26T10:12:21,436 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,436 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20245:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,437 20245 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-02-26T10:12:21,438 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,438 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20251:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,439 20251 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-02-26T10:12:21,440 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,441 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20257:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,442 20257 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-02-26T10:12:21,442 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,443 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20304:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,443 20304 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-02-26T10:12:21,444 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,445 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20310:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,445 20310 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-02-26T10:12:21,446 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,447 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20351:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,447 20351 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-02-26T10:12:21,448 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,449 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20363:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,449 20363 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-02-26T10:12:21,450 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,451 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20416:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-02-26T10:12:21,451 20416 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-02-26T10:12:21,452 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,457 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)’: 2024-02-26T10:12:21,458 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21038:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-02-26T10:12:21,459 21038 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_n_boxes); 2024-02-26T10:12:21,459 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~ 2024-02-26T10:12:21,460 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21075:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-02-26T10:12:21,461 21075 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_boxidx); 2024-02-26T10:12:21,462 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-02-26T10:12:47,953 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 2024-02-26T10:12:48,223 building 'moleculekit.atomselect_utils' extension 2024-02-26T10:12:48,224 creating build/temp.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-02-26T10:12:48,224 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-me8oktgj/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 2024-02-26T10:12:48,532 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:12:48,533 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:12:48,534 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:12:48,534 from moleculekit/atomselect_utils/atomselect_utils.cpp:1247: 2024-02-26T10:12:48,535 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:12:48,535 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:12:48,536 | ^~~~~~~ 2024-02-26T10:12:51,062 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 >&)’: 2024-02-26T10:12:51,063 moleculekit/atomselect_utils/atomselect_utils.cpp:23237:161: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-02-26T10:12:51,064 23237 | __pyx_t_3 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_2 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_resnum); 2024-02-26T10:12:51,065 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-02-26T10:12:51,071 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 >&)’: 2024-02-26T10:12:51,072 moleculekit/atomselect_utils/atomselect_utils.cpp:23489:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-02-26T10:12:51,073 23489 | __pyx_t_6 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_5 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_i); 2024-02-26T10:12:51,073 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-02-26T10:12:51,079 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 >&)’: 2024-02-26T10:12:51,080 moleculekit/atomselect_utils/atomselect_utils.cpp:23756:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-02-26T10:12:51,081 23756 | __pyx_t_6 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_5 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_i); 2024-02-26T10:12:51,081 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-02-26T10:13:25,351 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 2024-02-26T10:13:25,640 building 'moleculekit.distance_utils' extension 2024-02-26T10:13:25,641 creating build/temp.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-02-26T10:13:25,641 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-me8oktgj/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 2024-02-26T10:13:25,953 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:13:25,954 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:13:25,954 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:13:25,955 from moleculekit/distance_utils/distance_utils.cpp:1230: 2024-02-26T10:13:25,956 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:13:25,956 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:13:25,957 | ^~~~~~~ 2024-02-26T10:14:04,917 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 2024-02-26T10:14:05,214 building 'moleculekit.occupancy_utils' extension 2024-02-26T10:14:05,215 creating build/temp.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-02-26T10:14:05,215 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-me8oktgj/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 2024-02-26T10:14:05,528 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:14:05,529 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:14:05,529 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:14:05,530 from moleculekit/occupancy_utils/occupancy_utils.cpp:1230: 2024-02-26T10:14:05,531 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:14:05,531 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:14:05,532 | ^~~~~~~ 2024-02-26T10:14:32,664 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 2024-02-26T10:14:32,852 building 'moleculekit.cython_utils' extension 2024-02-26T10:14:32,853 creating build/temp.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-02-26T10:14:32,853 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-me8oktgj/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 2024-02-26T10:14:33,191 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:14:33,192 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:14:33,193 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:14:33,193 from moleculekit/cython_utils/cython_utils.cpp:1230: 2024-02-26T10:14:33,194 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:14:33,195 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:14:33,196 | ^~~~~~~ 2024-02-26T10:15:03,292 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 2024-02-26T10:15:03,584 building 'moleculekit.xtc' extension 2024-02-26T10:15:03,585 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats 2024-02-26T10:15:03,585 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-02-26T10:15:03,586 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-02-26T10:15:03,587 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-me8oktgj/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 2024-02-26T10:15:04,232 moleculekit/fileformats/xtc/src/xdrfile.cpp:66:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,232 66 | "OK", 2024-02-26T10:15:04,233 | ^~~~ 2024-02-26T10:15:04,234 moleculekit/fileformats/xtc/src/xdrfile.cpp:67:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,234 67 | "Header", 2024-02-26T10:15:04,235 | ^~~~~~~~ 2024-02-26T10:15:04,236 moleculekit/fileformats/xtc/src/xdrfile.cpp:68:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,237 68 | "String", 2024-02-26T10:15:04,237 | ^~~~~~~~ 2024-02-26T10:15:04,238 moleculekit/fileformats/xtc/src/xdrfile.cpp:69:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,238 69 | "Double", 2024-02-26T10:15:04,239 | ^~~~~~~~ 2024-02-26T10:15:04,240 moleculekit/fileformats/xtc/src/xdrfile.cpp:70:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,240 70 | "Integer", 2024-02-26T10:15:04,241 | ^~~~~~~~~ 2024-02-26T10:15:04,241 moleculekit/fileformats/xtc/src/xdrfile.cpp:71:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,242 71 | "Float", 2024-02-26T10:15:04,243 | ^~~~~~~ 2024-02-26T10:15:04,243 moleculekit/fileformats/xtc/src/xdrfile.cpp:72:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,244 72 | "Unsigned integer", 2024-02-26T10:15:04,244 | ^~~~~~~~~~~~~~~~~~ 2024-02-26T10:15:04,245 moleculekit/fileformats/xtc/src/xdrfile.cpp:73:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,246 73 | "Compressed 3D coordinate", 2024-02-26T10:15:04,246 | ^~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:15:04,247 moleculekit/fileformats/xtc/src/xdrfile.cpp:74:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,248 74 | "Closing file", 2024-02-26T10:15:04,248 | ^~~~~~~~~~~~~~ 2024-02-26T10:15:04,249 moleculekit/fileformats/xtc/src/xdrfile.cpp:75:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,250 75 | "Magic number", 2024-02-26T10:15:04,250 | ^~~~~~~~~~~~~~ 2024-02-26T10:15:04,251 moleculekit/fileformats/xtc/src/xdrfile.cpp:76:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,251 76 | "Not enough memory", 2024-02-26T10:15:04,252 | ^~~~~~~~~~~~~~~~~~~ 2024-02-26T10:15:04,253 moleculekit/fileformats/xtc/src/xdrfile.cpp:77:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,254 77 | "End of file", 2024-02-26T10:15:04,255 | ^~~~~~~~~~~~~ 2024-02-26T10:15:04,255 moleculekit/fileformats/xtc/src/xdrfile.cpp:78:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-02-26T10:15:04,256 78 | "File not found" 2024-02-26T10:15:04,257 | ^~~~~~~~~~~~~~~~ 2024-02-26T10:15:04,258 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofint(int)’: 2024-02-26T10:15:04,258 moleculekit/fileformats/xtc/src/xdrfile.cpp:459:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,259 459 | while (size >= num && num_of_bits < 32) 2024-02-26T10:15:04,260 | ~~~~~^~~~~~ 2024-02-26T10:15:04,260 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-02-26T10:15:04,261 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:04,262 505 | while (bytes[num_of_bytes] >= num) 2024-02-26T10:15:04,263 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-02-26T10:15:04,264 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-02-26T10:15:04,264 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,265 614 | if (num_of_bits >= num_of_bytes * 8) 2024-02-26T10:15:04,266 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-02-26T10:15:04,266 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,267 616 | for (i = 0; i < num_of_bytes; i++) 2024-02-26T10:15:04,268 | ~~^~~~~~~~~~~~~~ 2024-02-26T10:15:04,268 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,269 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-02-26T10:15:04,269 | ~~^~~~~~~~~~~~~~~~ 2024-02-26T10:15:04,270 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-02-26T10:15:04,270 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:30: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:04,271 664 | if (lastbits < num_of_bits) 2024-02-26T10:15:04,272 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-02-26T10:15:04,272 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-02-26T10:15:04,273 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:04,273 785 | if(size3>xfp->buf1size) 2024-02-26T10:15:04,274 | ~~~~~^~~~~~~~~~~~~~ 2024-02-26T10:15:04,275 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:04,276 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-02-26T10:15:04,279 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:04,280 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,280 935 | if(countmjh >= size3 ) { return -1; } 2024-02-26T10:15:04,281 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:04,282 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,283 938 | if(countmjh >= size3 ) { return -1; } 2024-02-26T10:15:04,283 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:04,284 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,284 945 | if(countmjh >= size3 ) { return -1; } 2024-02-26T10:15:04,285 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:04,286 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,287 948 | if(countmjh >= size3 ) { return -1; } 2024-02-26T10:15:04,288 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:04,288 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,289 951 | if(countmjh >= size3 ) { return -1; } 2024-02-26T10:15:04,289 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:04,290 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:24: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-02-26T10:15:04,290 756 | int smallidx, minidx, maxidx; 2024-02-26T10:15:04,291 | ^~~~~~ 2024-02-26T10:15:04,291 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:32: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-02-26T10:15:04,292 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-02-26T10:15:04,293 | ^~~~~~ 2024-02-26T10:15:04,293 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:13: warning: unused variable ‘errval’ [-Wunused-variable] 2024-02-26T10:15:04,294 763 | int errval=1; 2024-02-26T10:15:04,294 | ^~~~~~ 2024-02-26T10:15:04,295 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-02-26T10:15:04,295 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:04,296 1011 | if(size3>xfp->buf1size) 2024-02-26T10:15:04,296 | ~~~~~^~~~~~~~~~~~~~ 2024-02-26T10:15:04,297 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:41: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,298 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-02-26T10:15:04,298 | ~~~~~~~~^~~~~~~ 2024-02-26T10:15:04,299 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,300 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-02-26T10:15:04,301 | ~~~~~~~~^~~~~~~ 2024-02-26T10:15:04,301 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,302 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-02-26T10:15:04,303 | ~~~~~~~~^~~~~~~ 2024-02-26T10:15:04,304 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,304 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-02-26T10:15:04,305 | ^ 2024-02-26T10:15:04,306 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:04,307 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-02-26T10:15:04,315 | ~~~~~^~~~~~~~~~~~~~ 2024-02-26T10:15:04,315 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:04,316 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-02-26T10:15:04,325 | ~~~~~^~~~~~~~~~~~~~ 2024-02-26T10:15:04,325 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:04,326 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-02-26T10:15:04,326 | ^ 2024-02-26T10:15:04,327 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:04,328 1633 | maxidx = (LASTIDX= num && num_of_bits < 32) 2024-02-26T10:15:34,479 | ~~~~~^~~~~~ 2024-02-26T10:15:34,480 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-02-26T10:15:34,481 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:34,481 505 | while (bytes[num_of_bytes] >= num) 2024-02-26T10:15:34,482 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-02-26T10:15:34,483 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-02-26T10:15:34,484 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,484 614 | if (num_of_bits >= num_of_bytes * 8) 2024-02-26T10:15:34,485 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-02-26T10:15:34,486 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,486 616 | for (i = 0; i < num_of_bytes; i++) 2024-02-26T10:15:34,487 | ~~^~~~~~~~~~~~~~ 2024-02-26T10:15:34,488 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,488 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-02-26T10:15:34,489 | ~~^~~~~~~~~~~~~~~~ 2024-02-26T10:15:34,490 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-02-26T10:15:34,490 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:30: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:34,491 664 | if (lastbits < num_of_bits) 2024-02-26T10:15:34,492 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-02-26T10:15:34,493 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-02-26T10:15:34,493 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:34,494 785 | if(size3>xfp->buf1size) 2024-02-26T10:15:34,494 | ~~~~~^~~~~~~~~~~~~~ 2024-02-26T10:15:34,494 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:34,495 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-02-26T10:15:34,497 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:34,498 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,498 935 | if(countmjh >= size3 ) { return -1; } 2024-02-26T10:15:34,499 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:34,500 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,501 938 | if(countmjh >= size3 ) { return -1; } 2024-02-26T10:15:34,502 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:34,502 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,503 945 | if(countmjh >= size3 ) { return -1; } 2024-02-26T10:15:34,504 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:34,504 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,505 948 | if(countmjh >= size3 ) { return -1; } 2024-02-26T10:15:34,506 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:34,506 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,507 951 | if(countmjh >= size3 ) { return -1; } 2024-02-26T10:15:34,508 | ~~~~~~~~~^~~~~~~~ 2024-02-26T10:15:34,508 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:24: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-02-26T10:15:34,509 756 | int smallidx, minidx, maxidx; 2024-02-26T10:15:34,510 | ^~~~~~ 2024-02-26T10:15:34,510 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:32: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-02-26T10:15:34,511 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-02-26T10:15:34,512 | ^~~~~~ 2024-02-26T10:15:34,513 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:13: warning: unused variable ‘errval’ [-Wunused-variable] 2024-02-26T10:15:34,513 763 | int errval=1; 2024-02-26T10:15:34,514 | ^~~~~~ 2024-02-26T10:15:34,515 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-02-26T10:15:34,515 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:34,516 1011 | if(size3>xfp->buf1size) 2024-02-26T10:15:34,516 | ~~~~~^~~~~~~~~~~~~~ 2024-02-26T10:15:34,517 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:41: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,517 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-02-26T10:15:34,518 | ~~~~~~~~^~~~~~~ 2024-02-26T10:15:34,519 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,519 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-02-26T10:15:34,520 | ~~~~~~~~^~~~~~~ 2024-02-26T10:15:34,520 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,521 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-02-26T10:15:34,521 | ~~~~~~~~^~~~~~~ 2024-02-26T10:15:34,522 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,523 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-02-26T10:15:34,524 | ^ 2024-02-26T10:15:34,524 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:34,525 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-02-26T10:15:34,533 | ~~~~~^~~~~~~~~~~~~~ 2024-02-26T10:15:34,533 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:34,534 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-02-26T10:15:34,543 | ~~~~~^~~~~~~~~~~~~~ 2024-02-26T10:15:34,544 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:15:34,544 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-02-26T10:15:34,545 | ^ 2024-02-26T10:15:34,546 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:15:34,546 1633 | maxidx = (LASTIDX= __pyx_pybuffernd_forces.diminfo[2].shape)) __pyx_t_4 = 2; 2024-02-26T10:16:14,630 | ^ 2024-02-26T10:16:14,639 moleculekit/fileformats/xtc/trr.c:10073:21: note: ‘__pyx_pybuffernd_forces.diminfo[2].shape’ was declared here 2024-02-26T10:16:14,640 10073 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-02-26T10:16:14,640 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,650 moleculekit/fileformats/xtc/trr.c:11537:19: warning: ‘__pyx_pybuffernd_forces.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,651 11537 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_forces.diminfo[1].shape)) __pyx_t_4 = 1; 2024-02-26T10:16:14,651 | ^ 2024-02-26T10:16:14,660 moleculekit/fileformats/xtc/trr.c:10073:21: note: ‘__pyx_pybuffernd_forces.diminfo[1].shape’ was declared here 2024-02-26T10:16:14,661 10073 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-02-26T10:16:14,661 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,662 moleculekit/fileformats/xtc/trr.c:2491:95: warning: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,663 2491 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-02-26T10:16:14,664 | ^ 2024-02-26T10:16:14,672 moleculekit/fileformats/xtc/trr.c:10073:21: note: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ was declared here 2024-02-26T10:16:14,672 10073 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-02-26T10:16:14,673 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,683 moleculekit/fileformats/xtc/trr.c:11531:59: warning: ‘__pyx_pybuffernd_forces.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,683 11531 | __pyx_t_28 += __pyx_pybuffernd_forces.diminfo[0].shape; 2024-02-26T10:16:14,684 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-02-26T10:16:14,693 moleculekit/fileformats/xtc/trr.c:10073:21: note: ‘__pyx_pybuffernd_forces.diminfo[0].shape’ was declared here 2024-02-26T10:16:14,693 10073 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-02-26T10:16:14,694 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,703 moleculekit/fileformats/xtc/trr.c:11484:19: warning: ‘__pyx_pybuffernd_vel.diminfo[2].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,704 11484 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_vel.diminfo[2].shape)) __pyx_t_4 = 2; 2024-02-26T10:16:14,704 | ^ 2024-02-26T10:16:14,713 moleculekit/fileformats/xtc/trr.c:10089:21: note: ‘__pyx_pybuffernd_vel.diminfo[2].shape’ was declared here 2024-02-26T10:16:14,714 10089 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-02-26T10:16:14,714 | ^~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,724 moleculekit/fileformats/xtc/trr.c:11480:19: warning: ‘__pyx_pybuffernd_vel.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,725 11480 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_vel.diminfo[1].shape)) __pyx_t_4 = 1; 2024-02-26T10:16:14,725 | ^ 2024-02-26T10:16:14,734 moleculekit/fileformats/xtc/trr.c:10089:21: note: ‘__pyx_pybuffernd_vel.diminfo[1].shape’ was declared here 2024-02-26T10:16:14,735 10089 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-02-26T10:16:14,735 | ^~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,736 moleculekit/fileformats/xtc/trr.c:2491:95: warning: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,737 2491 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-02-26T10:16:14,738 | ^ 2024-02-26T10:16:14,746 moleculekit/fileformats/xtc/trr.c:10089:21: note: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ was declared here 2024-02-26T10:16:14,747 10089 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-02-26T10:16:14,747 | ^~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,757 moleculekit/fileformats/xtc/trr.c:11474:56: warning: ‘__pyx_pybuffernd_vel.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,758 11474 | __pyx_t_28 += __pyx_pybuffernd_vel.diminfo[0].shape; 2024-02-26T10:16:14,758 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-02-26T10:16:14,767 moleculekit/fileformats/xtc/trr.c:10089:21: note: ‘__pyx_pybuffernd_vel.diminfo[0].shape’ was declared here 2024-02-26T10:16:14,768 10089 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-02-26T10:16:14,769 | ^~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,778 moleculekit/fileformats/xtc/trr.c:11873:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,779 11873 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_xyz_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-02-26T10:16:14,780 | ^ 2024-02-26T10:16:14,789 moleculekit/fileformats/xtc/trr.c:10095:21: note: ‘__pyx_pybuffernd_xyz_buffer.diminfo[1].shape’ was declared here 2024-02-26T10:16:14,789 10095 | __Pyx_LocalBuf_ND __pyx_pybuffernd_xyz_buffer; 2024-02-26T10:16:14,790 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,800 moleculekit/fileformats/xtc/trr.c:11869:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,800 11869 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_xyz_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-02-26T10:16:14,801 | ^ 2024-02-26T10:16:14,810 moleculekit/fileformats/xtc/trr.c:10095:21: note: ‘__pyx_pybuffernd_xyz_buffer.diminfo[0].shape’ was declared here 2024-02-26T10:16:14,811 10095 | __Pyx_LocalBuf_ND __pyx_pybuffernd_xyz_buffer; 2024-02-26T10:16:14,811 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,821 moleculekit/fileformats/xtc/trr.c:11714:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,822 11714 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_vel_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-02-26T10:16:14,822 | ^ 2024-02-26T10:16:14,831 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_vel_buffer.diminfo[1].shape’ was declared here 2024-02-26T10:16:14,832 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel_buffer; 2024-02-26T10:16:14,832 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,842 moleculekit/fileformats/xtc/trr.c:11710:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,843 11710 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_vel_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-02-26T10:16:14,844 | ^ 2024-02-26T10:16:14,852 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_vel_buffer.diminfo[0].shape’ was declared here 2024-02-26T10:16:14,853 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel_buffer; 2024-02-26T10:16:14,854 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,863 moleculekit/fileformats/xtc/trr.c:11766:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,864 11766 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_forces_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-02-26T10:16:14,865 | ^ 2024-02-26T10:16:14,874 moleculekit/fileformats/xtc/trr.c:10075:21: note: ‘__pyx_pybuffernd_forces_buffer.diminfo[1].shape’ was declared here 2024-02-26T10:16:14,874 10075 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces_buffer; 2024-02-26T10:16:14,875 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:14,885 moleculekit/fileformats/xtc/trr.c:11762:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:14,885 11762 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_forces_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-02-26T10:16:14,886 | ^ 2024-02-26T10:16:14,895 moleculekit/fileformats/xtc/trr.c:10075:21: note: ‘__pyx_pybuffernd_forces_buffer.diminfo[0].shape’ was declared here 2024-02-26T10:16:14,896 10075 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces_buffer; 2024-02-26T10:16:14,896 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-02-26T10:16:21,482 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 2024-02-26T10:16:21,635 building 'moleculekit.dcd' extension 2024-02-26T10:16:21,636 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-02-26T10:16:21,637 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src 2024-02-26T10:16:21,638 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-me8oktgj/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 2024-02-26T10:16:22,043 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:16:22,043 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:16:22,044 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:16:22,044 from moleculekit/fileformats/dcd/dcd.c:1221: 2024-02-26T10:16:22,045 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:16:22,045 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:16:22,046 | ^~~~~~~ 2024-02-26T10:16:23,332 In file included from moleculekit/fileformats/dcd/include/dcdplugin.h:1, 2024-02-26T10:16:23,333 from moleculekit/fileformats/dcd/dcd.c:1227: 2024-02-26T10:16:23,334 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-02-26T10:16:23,334 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-02-26T10:16:23,335 | ^~~~~~~~~~~~~ 2024-02-26T10:16:23,336 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-02-26T10:16:23,337 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-02-26T10:16:23,337 | ^~~~~~~~~~~~~~ 2024-02-26T10:16:23,338 moleculekit/fileformats/dcd/include/fastio.h:466:12: warning: ‘fio_write_int32’ defined but not used [-Wunused-function] 2024-02-26T10:16:23,338 466 | static int fio_write_int32(fio_fd fd, int i) { 2024-02-26T10:16:23,339 | ^~~~~~~~~~~~~~~ 2024-02-26T10:16:23,340 moleculekit/fileformats/dcd/include/fastio.h:457:19: warning: ‘fio_ftell’ defined but not used [-Wunused-function] 2024-02-26T10:16:23,340 457 | static fio_size_t fio_ftell(fio_fd fd) { 2024-02-26T10:16:23,341 | ^~~~~~~~~ 2024-02-26T10:16:23,341 moleculekit/fileformats/dcd/include/fastio.h:450:19: warning: ‘fio_fseek’ defined but not used [-Wunused-function] 2024-02-26T10:16:23,342 450 | static fio_size_t fio_fseek(fio_fd fd, fio_size_t offset, int whence) { 2024-02-26T10:16:23,343 | ^~~~~~~~~ 2024-02-26T10:16:23,344 moleculekit/fileformats/dcd/include/fastio.h:415:19: warning: ‘fio_readv’ defined but not used [-Wunused-function] 2024-02-26T10:16:23,345 415 | static fio_size_t fio_readv(fio_fd fd, const fio_iovec * iov, int iovcnt) { 2024-02-26T10:16:23,346 | ^~~~~~~~~ 2024-02-26T10:16:23,347 moleculekit/fileformats/dcd/include/fastio.h:394:12: warning: ‘fio_fclose’ defined but not used [-Wunused-function] 2024-02-26T10:16:23,347 394 | static int fio_fclose(fio_fd fd) { 2024-02-26T10:16:23,348 | ^~~~~~~~~~ 2024-02-26T10:16:23,348 moleculekit/fileformats/dcd/include/fastio.h:366:12: warning: ‘fio_open’ defined but not used [-Wunused-function] 2024-02-26T10:16:23,349 366 | static int fio_open(const char *filename, int mode, fio_fd *fd) { 2024-02-26T10:16:23,349 | ^~~~~~~~ 2024-02-26T10:16:37,781 moleculekit/fileformats/dcd/dcd.c: In function ‘__pyx_pf_11moleculekit_3dcd_17DCDTrajectoryFile_18read’: 2024-02-26T10:16:37,781 moleculekit/fileformats/dcd/dcd.c:1123:40: warning: ‘__pyx_v_i’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:37,782 1123 | #define PyInt_FromLong PyLong_FromLong 2024-02-26T10:16:37,782 | ^~~~~~~~~~~~~~~ 2024-02-26T10:16:37,789 moleculekit/fileformats/dcd/dcd.c:8004:7: note: ‘__pyx_v_i’ was declared here 2024-02-26T10:16:37,790 8004 | int __pyx_v_i; 2024-02-26T10:16:37,790 | ^~~~~~~~~ 2024-02-26T10:16:41,186 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-me8oktgj/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 2024-02-26T10:16:41,405 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdheader’: 2024-02-26T10:16:41,405 moleculekit/fileformats/dcd/src/dcdplugin.c:150:55: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:16:41,406 150 | else if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-02-26T10:16:41,407 | ^~ 2024-02-26T10:16:41,407 moleculekit/fileformats/dcd/src/dcdplugin.c:173:54: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:16:41,408 173 | if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-02-26T10:16:41,409 | ^~ 2024-02-26T10:16:41,410 moleculekit/fileformats/dcd/src/dcdplugin.c:194:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:16:41,410 194 | if (input_integer[0] != dcdcordmagic) 2024-02-26T10:16:41,411 | ^~ 2024-02-26T10:16:41,412 moleculekit/fileformats/dcd/src/dcdplugin.c:409:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:16:41,412 409 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-02-26T10:16:41,413 | ^~ 2024-02-26T10:16:41,414 moleculekit/fileformats/dcd/src/dcdplugin.c:428:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-02-26T10:16:41,414 428 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-02-26T10:16:41,415 | ^~ 2024-02-26T10:16:41,417 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdstep’: 2024-02-26T10:16:41,418 moleculekit/fileformats/dcd/src/dcdplugin.c:651:23: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:16:41,419 651 | if (tmpbuf[i] != sizeof(float) * N) 2024-02-26T10:16:41,420 | ^~ 2024-02-26T10:16:41,421 moleculekit/fileformats/dcd/src/dcdplugin.c:659:49: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-02-26T10:16:41,421 659 | if ((tmpbuf[2 * i] + tmpbuf[2 * i + 1]) != sizeof(float) * N) 2024-02-26T10:16:41,422 | ^~ 2024-02-26T10:16:41,447 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:55: 2024-02-26T10:16:41,448 moleculekit/fileformats/dcd/include/endianswap.h: At top level: 2024-02-26T10:16:41,449 moleculekit/fileformats/dcd/include/endianswap.h:96:13: warning: ‘swap2_aligned’ defined but not used [-Wunused-function] 2024-02-26T10:16:41,449 96 | static void swap2_aligned(void *v, long ndata) { 2024-02-26T10:16:41,450 | ^~~~~~~~~~~~~ 2024-02-26T10:16:41,450 moleculekit/fileformats/dcd/include/endianswap.h:32:13: warning: ‘swap2_unaligned’ defined but not used [-Wunused-function] 2024-02-26T10:16:41,451 32 | static void swap2_unaligned(void *v, long ndata) { 2024-02-26T10:16:41,451 | ^~~~~~~~~~~~~~~ 2024-02-26T10:16:41,452 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:46: 2024-02-26T10:16:41,452 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-02-26T10:16:41,453 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-02-26T10:16:41,454 | ^~~~~~~~~~~~~ 2024-02-26T10:16:41,454 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-02-26T10:16:41,455 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-02-26T10:16:41,455 | ^~~~~~~~~~~~~~ 2024-02-26T10:16:42,739 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 2024-02-26T10:16:42,868 building 'moleculekit.binpos' extension 2024-02-26T10:16:42,868 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-02-26T10:16:42,869 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src 2024-02-26T10:16:42,871 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-me8oktgj/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 2024-02-26T10:16:43,264 In file included from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-02-26T10:16:43,265 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-02-26T10:16:43,266 from /tmp/pip-build-env-me8oktgj/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-02-26T10:16:43,267 from moleculekit/fileformats/binpos/binpos.c:1221: 2024-02-26T10:16:43,267 /tmp/pip-build-env-me8oktgj/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] 2024-02-26T10:16:43,268 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-02-26T10:16:43,269 | ^~~~~~~ 2024-02-26T10:16:57,908 In function ‘__pyx_pf_11moleculekit_6binpos_20BINPOSTrajectoryFile_6_read’, 2024-02-26T10:16:57,908 inlined from ‘__pyx_pw_11moleculekit_6binpos_20BINPOSTrajectoryFile_7_read’ at moleculekit/fileformats/binpos/binpos.c:7486:13: 2024-02-26T10:16:57,915 moleculekit/fileformats/binpos/binpos.c:8027:6: warning: ‘__pyx_v_status’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:57,916 8027 | if (__pyx_t_1) { 2024-02-26T10:16:57,917 | ^ 2024-02-26T10:16:57,917 moleculekit/fileformats/binpos/binpos.c: In function ‘__pyx_pw_11moleculekit_6binpos_20BINPOSTrajectoryFile_7_read’: 2024-02-26T10:16:57,923 moleculekit/fileformats/binpos/binpos.c:7504:7: note: ‘__pyx_v_status’ was declared here 2024-02-26T10:16:57,923 7504 | int __pyx_v_status; 2024-02-26T10:16:57,924 | ^~~~~~~~~~~~~~ 2024-02-26T10:16:57,925 moleculekit/fileformats/binpos/binpos.c:1123:40: warning: ‘__pyx_v_i’ may be used uninitialized [-Wmaybe-uninitialized] 2024-02-26T10:16:57,925 1123 | #define PyInt_FromLong PyLong_FromLong 2024-02-26T10:16:57,926 | ^~~~~~~~~~~~~~~ 2024-02-26T10:16:57,932 moleculekit/fileformats/binpos/binpos.c:7501:7: note: ‘__pyx_v_i’ was declared here 2024-02-26T10:16:57,933 7501 | int __pyx_v_i; 2024-02-26T10:16:57,933 | ^~~~~~~~~ 2024-02-26T10:17:01,398 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-me8oktgj/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 2024-02-26T10:17:01,729 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 2024-02-26T10:17:01,863 building 'moleculekit.tmalign' extension 2024-02-26T10:17:01,864 creating build/temp.linux-armv7l-cpython-311/moleculekit/tmalign 2024-02-26T10:17:01,865 creating build/temp.linux-armv7l-cpython-311/moleculekit/tmalign/src 2024-02-26T10:17:01,867 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-me8oktgj/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 2024-02-26T10:17:35,956 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-me8oktgj/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 2024-02-26T10:17:58,807 In file included from /usr/include/c++/12/vector:70, 2024-02-26T10:17:58,807 from moleculekit/tmalign/tmalign_util.cpp:1245: 2024-02-26T10:17:58,808 /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]’: 2024-02-26T10:17:58,809 /usr/include/c++/12/bits/vector.tcc:439:7: note: parameter passing for argument of type ‘std::vector::iterator’ changed in GCC 7.1 2024-02-26T10:17:58,810 439 | vector<_Tp, _Alloc>:: 2024-02-26T10:17:58,811 | ^~~~~~~~~~~~~~~~~~~ 2024-02-26T10:17:59,614 In file included from /usr/include/c++/12/vector:64: 2024-02-26T10:17:59,614 In member function ‘void std::vector<_Tp, _Alloc>::push_back(const value_type&) [with _Tp = double; _Alloc = std::allocator]’, 2024-02-26T10:17:59,615 inlined from ‘PyObject* __pyx_pf_11moleculekit_7tmalign_tmalign(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, std::string, std::string)’ at moleculekit/tmalign/tmalign_util.cpp:20761:32, 2024-02-26T10:17:59,615 inlined from ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/tmalign/tmalign_util.cpp:20246:52: 2024-02-26T10:17:59,616 /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 2024-02-26T10:17:59,617 1287 | _M_realloc_insert(end(), __x); 2024-02-26T10:17:59,617 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-02-26T10:17:59,618 In member function ‘void std::vector<_Tp, _Alloc>::push_back(const value_type&) [with _Tp = double; _Alloc = std::allocator]’, 2024-02-26T10:17:59,618 inlined from ‘PyObject* __pyx_pf_11moleculekit_7tmalign_tmalign(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, std::string, std::string)’ at moleculekit/tmalign/tmalign_util.cpp:20775:33, 2024-02-26T10:17:59,619 inlined from ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/tmalign/tmalign_util.cpp:20246:52: 2024-02-26T10:17:59,619 /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 2024-02-26T10:17:59,620 1287 | _M_realloc_insert(end(), __x); 2024-02-26T10:17:59,621 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-02-26T10:17:59,622 In member function ‘void std::vector<_Tp, _Alloc>::push_back(const value_type&) [with _Tp = double; _Alloc = std::allocator]’, 2024-02-26T10:17:59,622 inlined from ‘PyObject* __pyx_pf_11moleculekit_7tmalign_tmalign(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, std::string, std::string)’ at moleculekit/tmalign/tmalign_util.cpp:20860:34, 2024-02-26T10:17:59,623 inlined from ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/tmalign/tmalign_util.cpp:20246:52: 2024-02-26T10:17:59,624 /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 2024-02-26T10:17:59,624 1287 | _M_realloc_insert(end(), __x); 2024-02-26T10:17:59,625 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-02-26T10:18:02,001 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 2024-02-26T10:18:02,379 UPDATING build/lib.linux-armv7l-cpython-311/moleculekit/_version.py 2024-02-26T10:18:02,380 set build/lib.linux-armv7l-cpython-311/moleculekit/_version.py to '1.8.24' 2024-02-26T10:18:02,381 installing to build/bdist.linux-armv7l/wheel 2024-02-26T10:18:02,381 running install 2024-02-26T10:18:02,405 running install_lib 2024-02-26T10:18:02,411 creating build/bdist.linux-armv7l 2024-02-26T10:18:02,412 creating build/bdist.linux-armv7l/wheel 2024-02-26T10:18:02,414 creating build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:02,416 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-02-26T10:18:02,418 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-02-26T10:18:02,419 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/languageparser.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-02-26T10:18:02,422 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/analyze.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-02-26T10:18:02,425 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/atomselect.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-02-26T10:18:02,427 copying build/lib.linux-armv7l-cpython-311/moleculekit/align.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:02,430 creating build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,432 creating build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-02-26T10:18:02,433 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-02-26T10:18:02,435 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools/obabel_cli.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-02-26T10:18:02,437 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/voxeldescriptors.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,440 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/hhblitsprofile.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,442 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/crystalpacking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,445 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/graphalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,447 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/modelling.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,450 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/moleculechecks.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,453 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/detect.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,456 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,458 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/docking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,460 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/sequencestructuralalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,463 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/autosegment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,466 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/preparation_customres.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,469 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/atomtyper.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,472 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/preparation.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-02-26T10:18:02,476 creating build/bdist.linux-armv7l/wheel/moleculekit/share 2024-02-26T10:18:02,477 creating build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-02-26T10:18:02,479 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/atomselect/atomselect.json -> build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-02-26T10:18:02,481 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/opm_sequences.json -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-02-26T10:18:02,681 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/ALA.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-02-26T10:18:02,684 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/backbone.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-02-26T10:18:02,686 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr 2024-02-26T10:18:02,690 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,691 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,694 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/03Y.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,696 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ME0.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,698 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DPP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,700 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,702 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,704 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/P1L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,706 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PCA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,708 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2ML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,710 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,713 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ORM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,715 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2ML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,717 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,719 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/03Y.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,722 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/APD.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,724 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/P1L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,726 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/M3L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,728 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GHG.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,730 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HPE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,733 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/1MH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,735 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TRO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,737 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,739 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,742 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2AS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,744 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2GX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,746 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,748 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,750 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GNC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,752 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,755 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MMO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,757 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DA2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,759 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AHP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,763 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AA4.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,766 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,768 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CGU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,770 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HOX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,773 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/SEP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,775 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ME0.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,777 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,779 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PRK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,782 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,784 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,786 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,788 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,791 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,793 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DA2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,796 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YCM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,798 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/004.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,800 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ONL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,802 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,804 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2MR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,807 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PCA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,809 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2GX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,812 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,814 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HQA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,816 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2MR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,818 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NAL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,820 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,823 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,825 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,827 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,829 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,832 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,834 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,836 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TY2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,838 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,840 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0AF.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,842 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,844 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,846 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,847 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,849 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YNM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,851 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AHP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,853 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BB8.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,855 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,857 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0A1.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,859 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/1MH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,861 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/M3L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,863 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IIL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,865 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,867 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/5JP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,869 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,871 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,873 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NAL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,875 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OMX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,877 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/5JP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,878 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/D4P.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,881 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAB.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,882 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MMO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,884 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,886 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,888 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,890 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/004.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,892 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HHK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,894 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TRO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,895 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ABA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,897 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ONL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,899 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HQA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,901 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4IN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,902 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,904 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,906 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,908 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ESC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,910 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NZC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,912 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HYP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,914 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,916 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0BN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,918 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,919 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NZC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,921 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,923 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BTK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,925 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAB.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,927 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,929 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YCM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,931 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,933 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HPE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,934 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IIL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,936 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,938 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TPO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,940 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,941 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/.gitkeep -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,943 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TY2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,945 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,947 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,949 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/D4P.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,950 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GNC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,952 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CGU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,954 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,956 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,958 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ORM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,960 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/APD.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,962 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/FGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,964 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,966 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2AS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,968 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/SEP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,969 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BB8.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,971 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,973 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,975 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,976 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,978 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,980 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OMX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,982 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PRK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,985 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,987 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/KYN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,989 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,991 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,993 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0A1.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,995 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/I2M.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,997 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/KYN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:02,999 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/I2M.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,001 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DPP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,002 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0AF.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,004 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4IN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,006 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YNM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,008 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,010 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HYP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,012 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,014 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HHK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,015 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,017 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,019 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ESC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,021 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BTK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,024 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GHG.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,025 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HOX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,027 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,029 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TPO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,031 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0BN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,033 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,035 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,037 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AA4.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,039 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/FGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,040 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ABA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,042 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,044 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-02-26T10:18:03,047 copying build/lib.linux-armv7l-cpython-311/moleculekit/opm.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,049 copying build/lib.linux-armv7l-cpython-311/moleculekit/dcd.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,064 copying build/lib.linux-armv7l-cpython-311/moleculekit/version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,066 copying build/lib.linux-armv7l-cpython-311/moleculekit/vmdgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,068 copying build/lib.linux-armv7l-cpython-311/moleculekit/viewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,071 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,097 copying build/lib.linux-armv7l-cpython-311/moleculekit/vmd_wrapper -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,099 copying build/lib.linux-armv7l-cpython-311/moleculekit/pymolgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,101 creating build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-02-26T10:18:03,102 copying build/lib.linux-armv7l-cpython-311/moleculekit/wrapping/wrapping.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-02-26T10:18:03,122 copying build/lib.linux-armv7l-cpython-311/moleculekit/wrapping/wrapping.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-02-26T10:18:03,125 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-02-26T10:18:03,127 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-02-26T10:18:03,128 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/PdbxWriterTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-02-26T10:18:03,131 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-02-26T10:18:03,133 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/PdbxReaderTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-02-26T10:18:03,135 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-02-26T10:18:03,138 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-02-26T10:18:03,140 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/PdbxParser.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-02-26T10:18:03,143 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/PdbxReader.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-02-26T10:18:03,146 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/PdbxContainers.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-02-26T10:18:03,150 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-02-26T10:18:03,152 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-02-26T10:18:03,154 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-02-26T10:18:03,156 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer/PdbxWriter.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-02-26T10:18:03,159 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-02-26T10:18:03,161 copying build/lib.linux-armv7l-cpython-311/moleculekit/trr.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,186 creating build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,188 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metrictmscore.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,190 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricfluctuation.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,193 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricdihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,196 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricplumed2.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,199 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricrmsd.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,201 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricdistance.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,204 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricsphericalcoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,207 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,208 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricgyration.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,211 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricshell.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,213 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricsasa.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,215 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricsecondarystructure.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,218 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/projection.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,219 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metriccoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,222 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-02-26T10:18:03,224 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,257 creating build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-02-26T10:18:03,258 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils/distance_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-02-26T10:18:03,261 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils/distance_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-02-26T10:18:03,281 copying build/lib.linux-armv7l-cpython-311/moleculekit/wrapping.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,299 copying build/lib.linux-armv7l-cpython-311/moleculekit/home.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,301 copying build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,324 copying build/lib.linux-armv7l-cpython-311/moleculekit/writers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,328 creating build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-02-26T10:18:03,329 copying build/lib.linux-armv7l-cpython-311/moleculekit/ply/lex.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-02-26T10:18:03,332 copying build/lib.linux-armv7l-cpython-311/moleculekit/ply/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-02-26T10:18:03,334 copying build/lib.linux-armv7l-cpython-311/moleculekit/ply/yacc.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-02-26T10:18:03,338 copying build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,362 copying build/lib.linux-armv7l-cpython-311/moleculekit/dihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,364 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,367 copying build/lib.linux-armv7l-cpython-311/moleculekit/periodictable.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,370 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-02-26T10:18:03,371 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/tmalign_util.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-02-26T10:18:03,374 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-02-26T10:18:03,375 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/src/TMAlign.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-02-26T10:18:03,382 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/tmalignlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-02-26T10:18:03,385 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-02-26T10:18:03,386 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/include/TMAlign.h -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-02-26T10:18:03,389 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/tmalign_util.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-02-26T10:18:03,420 copying build/lib.linux-armv7l-cpython-311/moleculekit/xtc.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,447 copying build/lib.linux-armv7l-cpython-311/moleculekit/binpos.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,460 copying build/lib.linux-armv7l-cpython-311/moleculekit/config.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,462 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,464 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,499 creating build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-02-26T10:18:03,500 copying build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils/occupancy_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-02-26T10:18:03,502 copying build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils/occupancy_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-02-26T10:18:03,520 creating build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-02-26T10:18:03,521 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-02-26T10:18:03,524 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-02-26T10:18:03,549 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-02-26T10:18:03,550 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils/atomselect_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-02-26T10:18:03,573 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils/atomselect_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-02-26T10:18:03,576 copying build/lib.linux-armv7l-cpython-311/moleculekit/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,577 copying build/lib.linux-armv7l-cpython-311/moleculekit/logging.ini -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,580 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-02-26T10:18:03,581 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/netcdf.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-02-26T10:18:03,584 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-02-26T10:18:03,585 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binpos.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-02-26T10:18:03,589 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-02-26T10:18:03,590 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src/binposplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-02-26T10:18:03,593 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-02-26T10:18:03,594 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include/binposplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-02-26T10:18:03,596 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-02-26T10:18:03,599 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-02-26T10:18:03,601 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binposlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-02-26T10:18:03,602 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binpos.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-02-26T10:18:03,619 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-02-26T10:18:03,621 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/utils.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-02-26T10:18:03,623 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-02-26T10:18:03,624 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xtc.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-02-26T10:18:03,627 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/trr.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-02-26T10:18:03,629 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xtclib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-02-26T10:18:03,631 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-02-26T10:18:03,632 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-02-26T10:18:03,635 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-02-26T10:18:03,637 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdr_seek.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-02-26T10:18:03,639 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-02-26T10:18:03,641 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-02-26T10:18:03,645 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-02-26T10:18:03,663 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-02-26T10:18:03,686 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xdrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-02-26T10:18:03,689 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-02-26T10:18:03,690 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-02-26T10:18:03,692 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-02-26T10:18:03,694 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/trr_header.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-02-26T10:18:03,695 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdrfile.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-02-26T10:18:03,698 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-02-26T10:18:03,700 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdr_seek.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-02-26T10:18:03,702 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/trrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-02-26T10:18:03,704 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-02-26T10:18:03,705 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-02-26T10:18:03,706 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src/dcdplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-02-26T10:18:03,709 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcd.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-02-26T10:18:03,712 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-02-26T10:18:03,713 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/endianswap.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-02-26T10:18:03,716 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/fastio.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-02-26T10:18:03,718 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/dcdplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-02-26T10:18:03,720 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-02-26T10:18:03,723 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-02-26T10:18:03,726 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcd.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-02-26T10:18:03,744 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcdlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-02-26T10:18:03,746 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-02-26T10:18:03,747 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-02-26T10:18:03,776 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-02-26T10:18:03,802 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-02-26T10:18:03,804 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds/hbonds.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-02-26T10:18:03,824 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds/hbonds.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-02-26T10:18:03,827 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-02-26T10:18:03,828 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi/cationpi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-02-26T10:18:03,852 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi/cationpi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-02-26T10:18:03,854 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-02-26T10:18:03,855 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole/sigmahole.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-02-26T10:18:03,877 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole/sigmahole.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-02-26T10:18:03,879 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/interactions.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-02-26T10:18:03,882 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-02-26T10:18:03,903 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-02-26T10:18:03,906 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-02-26T10:18:03,907 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi/pipi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-02-26T10:18:03,909 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi/pipi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-02-26T10:18:03,935 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-02-26T10:18:03,956 copying build/lib.linux-armv7l-cpython-311/moleculekit/rcsb.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,958 copying build/lib.linux-armv7l-cpython-311/moleculekit/molecule.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,962 copying build/lib.linux-armv7l-cpython-311/moleculekit/rdkitintegration.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,964 creating build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-02-26T10:18:03,965 copying build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils/cython_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-02-26T10:18:03,967 copying build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils/cython_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-02-26T10:18:03,987 copying build/lib.linux-armv7l-cpython-311/moleculekit/_version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,989 copying build/lib.linux-armv7l-cpython-311/moleculekit/vmdviewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:03,991 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:04,037 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-02-26T10:18:04,039 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-02-26T10:18:04,040 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-02-26T10:18:04,042 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/restrainedembed.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-02-26T10:18:04,044 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/clustering.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-02-26T10:18:04,046 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/test_tools.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-02-26T10:18:04,049 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-02-26T10:18:04,051 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/test_smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-02-26T10:18:04,053 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/test_smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-02-26T10:18:04,055 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-02-26T10:18:04,057 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-02-26T10:18:04,059 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-02-26T10:18:04,062 copying build/lib.linux-armv7l-cpython-311/moleculekit/util.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:04,064 copying build/lib.linux-armv7l-cpython-311/moleculekit/readers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-02-26T10:18:04,069 running install_egg_info 2024-02-26T10:18:04,074 Copying moleculekit.egg-info to build/bdist.linux-armv7l/wheel/moleculekit-1.8.24-py3.11.egg-info 2024-02-26T10:18:04,086 running install_scripts 2024-02-26T10:18:04,136 creating build/bdist.linux-armv7l/wheel/moleculekit-1.8.24.dist-info/WHEEL 2024-02-26T10:18:04,139 creating '/tmp/pip-wheel-nyiu0sk5/.tmp-dyy0n9l7/moleculekit-1.8.24-cp311-cp311-linux_armv7l.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2024-02-26T10:18:04,142 adding 'moleculekit/__init__.py' 2024-02-26T10:18:04,143 adding 'moleculekit/_version.py' 2024-02-26T10:18:04,145 adding 'moleculekit/align.py' 2024-02-26T10:18:04,505 adding 'moleculekit/atomselect_utils.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:04,664 adding 'moleculekit/binpos.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:04,670 adding 'moleculekit/bondguesser.py' 2024-02-26T10:18:04,914 adding 'moleculekit/bondguesser_utils.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:04,923 adding 'moleculekit/config.py' 2024-02-26T10:18:05,184 adding 'moleculekit/cython_utils.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:05,346 adding 'moleculekit/dcd.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:05,352 adding 'moleculekit/dihedral.py' 2024-02-26T10:18:05,354 adding 'moleculekit/distance.py' 2024-02-26T10:18:05,666 adding 'moleculekit/distance_utils.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:05,677 adding 'moleculekit/home.py' 2024-02-26T10:18:05,678 adding 'moleculekit/logging.ini' 2024-02-26T10:18:05,692 adding 'moleculekit/molecule.py' 2024-02-26T10:18:05,922 adding 'moleculekit/occupancy_utils.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:05,930 adding 'moleculekit/opm.py' 2024-02-26T10:18:05,933 adding 'moleculekit/periodictable.py' 2024-02-26T10:18:05,934 adding 'moleculekit/pymolgraphics.py' 2024-02-26T10:18:05,935 adding 'moleculekit/rcsb.py' 2024-02-26T10:18:05,937 adding 'moleculekit/rdkitintegration.py' 2024-02-26T10:18:05,951 adding 'moleculekit/readers.py' 2024-02-26T10:18:06,550 adding 'moleculekit/tmalign.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:06,854 adding 'moleculekit/trr.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:06,865 adding 'moleculekit/util.py' 2024-02-26T10:18:06,867 adding 'moleculekit/version.py' 2024-02-26T10:18:06,868 adding 'moleculekit/viewer.py' 2024-02-26T10:18:06,870 adding 'moleculekit/vmd_wrapper' 2024-02-26T10:18:06,872 adding 'moleculekit/vmdgraphics.py' 2024-02-26T10:18:06,874 adding 'moleculekit/vmdviewer.py' 2024-02-26T10:18:07,128 adding 'moleculekit/wrapping.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:07,142 adding 'moleculekit/writers.py' 2024-02-26T10:18:07,403 adding 'moleculekit/xtc.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:07,412 adding 'moleculekit/atomselect/__init__.py' 2024-02-26T10:18:07,414 adding 'moleculekit/atomselect/analyze.py' 2024-02-26T10:18:07,416 adding 'moleculekit/atomselect/atomselect.py' 2024-02-26T10:18:07,418 adding 'moleculekit/atomselect/languageparser.py' 2024-02-26T10:18:07,521 adding 'moleculekit/atomselect_utils/atomselect_utils.cpp' 2024-02-26T10:18:07,532 adding 'moleculekit/atomselect_utils/atomselect_utils.pyx' 2024-02-26T10:18:07,623 adding 'moleculekit/bondguesser_utils/bondguesser_utils.cpp' 2024-02-26T10:18:07,632 adding 'moleculekit/bondguesser_utils/bondguesser_utils.pyx' 2024-02-26T10:18:07,720 adding 'moleculekit/cython_utils/cython_utils.cpp' 2024-02-26T10:18:07,729 adding 'moleculekit/cython_utils/cython_utils.pyx' 2024-02-26T10:18:07,832 adding 'moleculekit/distance_utils/distance_utils.cpp' 2024-02-26T10:18:07,842 adding 'moleculekit/distance_utils/distance_utils.pyx' 2024-02-26T10:18:07,844 adding 'moleculekit/fileformats/__init__.py' 2024-02-26T10:18:07,849 adding 'moleculekit/fileformats/netcdf.py' 2024-02-26T10:18:07,850 adding 'moleculekit/fileformats/utils.py' 2024-02-26T10:18:07,911 adding 'moleculekit/fileformats/binpos/binpos.c' 2024-02-26T10:18:07,918 adding 'moleculekit/fileformats/binpos/binpos.pyx' 2024-02-26T10:18:07,920 adding 'moleculekit/fileformats/binpos/binposlib.pxd' 2024-02-26T10:18:07,921 adding 'moleculekit/fileformats/binpos/include/binposplugin.h' 2024-02-26T10:18:07,922 adding 'moleculekit/fileformats/binpos/include/largefiles.h' 2024-02-26T10:18:07,927 adding 'moleculekit/fileformats/binpos/include/molfile_plugin.h' 2024-02-26T10:18:07,930 adding 'moleculekit/fileformats/binpos/src/binposplugin.c' 2024-02-26T10:18:07,993 adding 'moleculekit/fileformats/dcd/dcd.c' 2024-02-26T10:18:08,000 adding 'moleculekit/fileformats/dcd/dcd.pyx' 2024-02-26T10:18:08,002 adding 'moleculekit/fileformats/dcd/dcdlib.pxd' 2024-02-26T10:18:08,003 adding 'moleculekit/fileformats/dcd/include/dcdplugin.h' 2024-02-26T10:18:08,005 adding 'moleculekit/fileformats/dcd/include/endianswap.h' 2024-02-26T10:18:08,007 adding 'moleculekit/fileformats/dcd/include/fastio.h' 2024-02-26T10:18:08,008 adding 'moleculekit/fileformats/dcd/include/largefiles.h' 2024-02-26T10:18:08,013 adding 'moleculekit/fileformats/dcd/include/molfile_plugin.h' 2024-02-26T10:18:08,018 adding 'moleculekit/fileformats/dcd/src/dcdplugin.c' 2024-02-26T10:18:08,113 adding 'moleculekit/fileformats/xtc/trr.c' 2024-02-26T10:18:08,124 adding 'moleculekit/fileformats/xtc/trr.pyx' 2024-02-26T10:18:08,125 adding 'moleculekit/fileformats/xtc/trrlib.pxd' 2024-02-26T10:18:08,126 adding 'moleculekit/fileformats/xtc/xdrlib.pxd' 2024-02-26T10:18:08,215 adding 'moleculekit/fileformats/xtc/xtc.cpp' 2024-02-26T10:18:08,223 adding 'moleculekit/fileformats/xtc/xtc.pyx' 2024-02-26T10:18:08,224 adding 'moleculekit/fileformats/xtc/xtclib.pxd' 2024-02-26T10:18:08,226 adding 'moleculekit/fileformats/xtc/include/trr_header.h' 2024-02-26T10:18:08,227 adding 'moleculekit/fileformats/xtc/include/xdr_seek.h' 2024-02-26T10:18:08,230 adding 'moleculekit/fileformats/xtc/include/xdrfile.h' 2024-02-26T10:18:08,231 adding 'moleculekit/fileformats/xtc/include/xdrfile_trr.h' 2024-02-26T10:18:08,233 adding 'moleculekit/fileformats/xtc/include/xdrfile_xtc.h' 2024-02-26T10:18:08,234 adding 'moleculekit/fileformats/xtc/include/xtc.h' 2024-02-26T10:18:08,236 adding 'moleculekit/fileformats/xtc/src/xdr_seek.c' 2024-02-26T10:18:08,242 adding 'moleculekit/fileformats/xtc/src/xdrfile.cpp' 2024-02-26T10:18:08,245 adding 'moleculekit/fileformats/xtc/src/xdrfile_trr.c' 2024-02-26T10:18:08,246 adding 'moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp' 2024-02-26T10:18:08,248 adding 'moleculekit/fileformats/xtc/src/xtc.cpp' 2024-02-26T10:18:08,250 adding 'moleculekit/interactions/__init__.py' 2024-02-26T10:18:08,532 adding 'moleculekit/interactions/cationpi.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:08,798 adding 'moleculekit/interactions/hbonds.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:08,810 adding 'moleculekit/interactions/interactions.py' 2024-02-26T10:18:09,086 adding 'moleculekit/interactions/pipi.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:09,369 adding 'moleculekit/interactions/sigmahole.cpython-311-arm-linux-gnueabihf.so' 2024-02-26T10:18:09,470 adding 'moleculekit/interactions/cationpi/cationpi.cpp' 2024-02-26T10:18:09,479 adding 'moleculekit/interactions/cationpi/cationpi.pyx' 2024-02-26T10:18:09,569 adding 'moleculekit/interactions/hbonds/hbonds.cpp' 2024-02-26T10:18:09,577 adding 'moleculekit/interactions/hbonds/hbonds.pyx' 2024-02-26T10:18:09,668 adding 'moleculekit/interactions/pipi/pipi.cpp' 2024-02-26T10:18:09,677 adding 'moleculekit/interactions/pipi/pipi.pyx' 2024-02-26T10:18:09,768 adding 'moleculekit/interactions/sigmahole/sigmahole.cpp' 2024-02-26T10:18:09,777 adding 'moleculekit/interactions/sigmahole/sigmahole.pyx' 2024-02-26T10:18:09,864 adding 'moleculekit/occupancy_utils/occupancy_utils.cpp' 2024-02-26T10:18:09,872 adding 'moleculekit/occupancy_utils/occupancy_utils.pyx' 2024-02-26T10:18:09,873 adding 'moleculekit/pdbx/__init__.py' 2024-02-26T10:18:09,877 adding 'moleculekit/pdbx/reader/PdbxContainers.py' 2024-02-26T10:18:09,879 adding 'moleculekit/pdbx/reader/PdbxParser.py' 2024-02-26T10:18:09,882 adding 'moleculekit/pdbx/reader/PdbxReader.py' 2024-02-26T10:18:09,883 adding 'moleculekit/pdbx/reader/__init__.py' 2024-02-26T10:18:09,885 adding 'moleculekit/pdbx/tests/PdbxReadWriteTests.py' 2024-02-26T10:18:09,886 adding 'moleculekit/pdbx/tests/PdbxReaderTests.py' 2024-02-26T10:18:09,888 adding 'moleculekit/pdbx/tests/PdbxWriterTests.py' 2024-02-26T10:18:09,889 adding 'moleculekit/pdbx/tests/__init__.py' 2024-02-26T10:18:09,891 adding 'moleculekit/pdbx/writer/PdbxWriter.py' 2024-02-26T10:18:09,892 adding 'moleculekit/pdbx/writer/__init__.py' 2024-02-26T10:18:09,893 adding 'moleculekit/ply/__init__.py' 2024-02-26T10:18:09,897 adding 'moleculekit/ply/lex.py' 2024-02-26T10:18:09,909 adding 'moleculekit/ply/yacc.py' 2024-02-26T10:18:09,911 adding 'moleculekit/projections/__init__.py' 2024-02-26T10:18:09,913 adding 'moleculekit/projections/metriccoordinate.py' 2024-02-26T10:18:09,916 adding 'moleculekit/projections/metricdihedral.py' 2024-02-26T10:18:09,920 adding 'moleculekit/projections/metricdistance.py' 2024-02-26T10:18:09,922 adding 'moleculekit/projections/metricfluctuation.py' 2024-02-26T10:18:09,924 adding 'moleculekit/projections/metricgyration.py' 2024-02-26T10:18:09,927 adding 'moleculekit/projections/metricplumed2.py' 2024-02-26T10:18:09,929 adding 'moleculekit/projections/metricrmsd.py' 2024-02-26T10:18:09,931 adding 'moleculekit/projections/metricsasa.py' 2024-02-26T10:18:09,933 adding 'moleculekit/projections/metricsecondarystructure.py' 2024-02-26T10:18:09,935 adding 'moleculekit/projections/metricshell.py' 2024-02-26T10:18:09,937 adding 'moleculekit/projections/metricsphericalcoordinate.py' 2024-02-26T10:18:09,938 adding 'moleculekit/projections/metrictmscore.py' 2024-02-26T10:18:09,939 adding 'moleculekit/projections/projection.py' 2024-02-26T10:18:09,941 adding 'moleculekit/projections/util.py' 2024-02-26T10:18:09,943 adding 'moleculekit/share/ALA.cif' 2024-02-26T10:18:09,944 adding 'moleculekit/share/backbone.cif' 2024-02-26T10:18:11,241 adding 'moleculekit/share/opm_sequences.json' 2024-02-26T10:18:11,326 adding 'moleculekit/share/atomselect/atomselect.json' 2024-02-26T10:18:11,331 adding 'moleculekit/share/pdb2pqr/residues/.gitkeep' 2024-02-26T10:18:11,332 adding 'moleculekit/share/pdb2pqr/residues/004.dat' 2024-02-26T10:18:11,333 adding 'moleculekit/share/pdb2pqr/residues/004.xml' 2024-02-26T10:18:11,334 adding 'moleculekit/share/pdb2pqr/residues/03Y.dat' 2024-02-26T10:18:11,335 adding 'moleculekit/share/pdb2pqr/residues/03Y.xml' 2024-02-26T10:18:11,337 adding 'moleculekit/share/pdb2pqr/residues/0A1.dat' 2024-02-26T10:18:11,338 adding 'moleculekit/share/pdb2pqr/residues/0A1.xml' 2024-02-26T10:18:11,339 adding 'moleculekit/share/pdb2pqr/residues/0AF.dat' 2024-02-26T10:18:11,341 adding 'moleculekit/share/pdb2pqr/residues/0AF.xml' 2024-02-26T10:18:11,342 adding 'moleculekit/share/pdb2pqr/residues/0BN.dat' 2024-02-26T10:18:11,343 adding 'moleculekit/share/pdb2pqr/residues/0BN.xml' 2024-02-26T10:18:11,344 adding 'moleculekit/share/pdb2pqr/residues/1MH.dat' 2024-02-26T10:18:11,345 adding 'moleculekit/share/pdb2pqr/residues/1MH.xml' 2024-02-26T10:18:11,346 adding 'moleculekit/share/pdb2pqr/residues/2AS.dat' 2024-02-26T10:18:11,347 adding 'moleculekit/share/pdb2pqr/residues/2AS.xml' 2024-02-26T10:18:11,348 adding 'moleculekit/share/pdb2pqr/residues/2GX.dat' 2024-02-26T10:18:11,350 adding 'moleculekit/share/pdb2pqr/residues/2GX.xml' 2024-02-26T10:18:11,351 adding 'moleculekit/share/pdb2pqr/residues/2ML.dat' 2024-02-26T10:18:11,352 adding 'moleculekit/share/pdb2pqr/residues/2ML.xml' 2024-02-26T10:18:11,353 adding 'moleculekit/share/pdb2pqr/residues/2MR.dat' 2024-02-26T10:18:11,354 adding 'moleculekit/share/pdb2pqr/residues/2MR.xml' 2024-02-26T10:18:11,356 adding 'moleculekit/share/pdb2pqr/residues/4IN.dat' 2024-02-26T10:18:11,357 adding 'moleculekit/share/pdb2pqr/residues/4IN.xml' 2024-02-26T10:18:11,358 adding 'moleculekit/share/pdb2pqr/residues/4PH.dat' 2024-02-26T10:18:11,359 adding 'moleculekit/share/pdb2pqr/residues/4PH.xml' 2024-02-26T10:18:11,360 adding 'moleculekit/share/pdb2pqr/residues/4PQ.dat' 2024-02-26T10:18:11,362 adding 'moleculekit/share/pdb2pqr/residues/4PQ.xml' 2024-02-26T10:18:11,363 adding 'moleculekit/share/pdb2pqr/residues/5JP.dat' 2024-02-26T10:18:11,364 adding 'moleculekit/share/pdb2pqr/residues/5JP.xml' 2024-02-26T10:18:11,365 adding 'moleculekit/share/pdb2pqr/residues/AA4.dat' 2024-02-26T10:18:11,366 adding 'moleculekit/share/pdb2pqr/residues/AA4.xml' 2024-02-26T10:18:11,367 adding 'moleculekit/share/pdb2pqr/residues/ABA.dat' 2024-02-26T10:18:11,368 adding 'moleculekit/share/pdb2pqr/residues/ABA.xml' 2024-02-26T10:18:11,370 adding 'moleculekit/share/pdb2pqr/residues/AHP.dat' 2024-02-26T10:18:11,371 adding 'moleculekit/share/pdb2pqr/residues/AHP.xml' 2024-02-26T10:18:11,372 adding 'moleculekit/share/pdb2pqr/residues/ALC.dat' 2024-02-26T10:18:11,373 adding 'moleculekit/share/pdb2pqr/residues/ALC.xml' 2024-02-26T10:18:11,375 adding 'moleculekit/share/pdb2pqr/residues/ALN.dat' 2024-02-26T10:18:11,376 adding 'moleculekit/share/pdb2pqr/residues/ALN.xml' 2024-02-26T10:18:11,377 adding 'moleculekit/share/pdb2pqr/residues/ALY.dat' 2024-02-26T10:18:11,378 adding 'moleculekit/share/pdb2pqr/residues/ALY.xml' 2024-02-26T10:18:11,380 adding 'moleculekit/share/pdb2pqr/residues/APD.dat' 2024-02-26T10:18:11,381 adding 'moleculekit/share/pdb2pqr/residues/APD.xml' 2024-02-26T10:18:11,382 adding 'moleculekit/share/pdb2pqr/residues/BB8.dat' 2024-02-26T10:18:11,383 adding 'moleculekit/share/pdb2pqr/residues/BB8.xml' 2024-02-26T10:18:11,385 adding 'moleculekit/share/pdb2pqr/residues/BCS.dat' 2024-02-26T10:18:11,386 adding 'moleculekit/share/pdb2pqr/residues/BCS.xml' 2024-02-26T10:18:11,387 adding 'moleculekit/share/pdb2pqr/residues/BTK.dat' 2024-02-26T10:18:11,388 adding 'moleculekit/share/pdb2pqr/residues/BTK.xml' 2024-02-26T10:18:11,390 adding 'moleculekit/share/pdb2pqr/residues/CCS.dat' 2024-02-26T10:18:11,391 adding 'moleculekit/share/pdb2pqr/residues/CCS.xml' 2024-02-26T10:18:11,392 adding 'moleculekit/share/pdb2pqr/residues/CGU.dat' 2024-02-26T10:18:11,393 adding 'moleculekit/share/pdb2pqr/residues/CGU.xml' 2024-02-26T10:18:11,396 adding 'moleculekit/share/pdb2pqr/residues/CSA.dat' 2024-02-26T10:18:11,397 adding 'moleculekit/share/pdb2pqr/residues/CSA.xml' 2024-02-26T10:18:11,398 adding 'moleculekit/share/pdb2pqr/residues/CSO.dat' 2024-02-26T10:18:11,399 adding 'moleculekit/share/pdb2pqr/residues/CSO.xml' 2024-02-26T10:18:11,401 adding 'moleculekit/share/pdb2pqr/residues/CSP.dat' 2024-02-26T10:18:11,402 adding 'moleculekit/share/pdb2pqr/residues/CSP.xml' 2024-02-26T10:18:11,403 adding 'moleculekit/share/pdb2pqr/residues/CSS.dat' 2024-02-26T10:18:11,404 adding 'moleculekit/share/pdb2pqr/residues/CSS.xml' 2024-02-26T10:18:11,405 adding 'moleculekit/share/pdb2pqr/residues/D4P.dat' 2024-02-26T10:18:11,406 adding 'moleculekit/share/pdb2pqr/residues/D4P.xml' 2024-02-26T10:18:11,407 adding 'moleculekit/share/pdb2pqr/residues/DA2.dat' 2024-02-26T10:18:11,409 adding 'moleculekit/share/pdb2pqr/residues/DA2.xml' 2024-02-26T10:18:11,410 adding 'moleculekit/share/pdb2pqr/residues/DAB.dat' 2024-02-26T10:18:11,411 adding 'moleculekit/share/pdb2pqr/residues/DAB.xml' 2024-02-26T10:18:11,412 adding 'moleculekit/share/pdb2pqr/residues/DAH.dat' 2024-02-26T10:18:11,413 adding 'moleculekit/share/pdb2pqr/residues/DAH.xml' 2024-02-26T10:18:11,414 adding 'moleculekit/share/pdb2pqr/residues/DPP.dat' 2024-02-26T10:18:11,415 adding 'moleculekit/share/pdb2pqr/residues/DPP.xml' 2024-02-26T10:18:11,416 adding 'moleculekit/share/pdb2pqr/residues/ESC.dat' 2024-02-26T10:18:11,418 adding 'moleculekit/share/pdb2pqr/residues/ESC.xml' 2024-02-26T10:18:11,419 adding 'moleculekit/share/pdb2pqr/residues/FGL.dat' 2024-02-26T10:18:11,420 adding 'moleculekit/share/pdb2pqr/residues/FGL.xml' 2024-02-26T10:18:11,421 adding 'moleculekit/share/pdb2pqr/residues/GHG.dat' 2024-02-26T10:18:11,422 adding 'moleculekit/share/pdb2pqr/residues/GHG.xml' 2024-02-26T10:18:11,423 adding 'moleculekit/share/pdb2pqr/residues/GME.dat' 2024-02-26T10:18:11,424 adding 'moleculekit/share/pdb2pqr/residues/GME.xml' 2024-02-26T10:18:11,426 adding 'moleculekit/share/pdb2pqr/residues/GNC.dat' 2024-02-26T10:18:11,427 adding 'moleculekit/share/pdb2pqr/residues/GNC.xml' 2024-02-26T10:18:11,428 adding 'moleculekit/share/pdb2pqr/residues/HHK.dat' 2024-02-26T10:18:11,429 adding 'moleculekit/share/pdb2pqr/residues/HHK.xml' 2024-02-26T10:18:11,431 adding 'moleculekit/share/pdb2pqr/residues/HLU.dat' 2024-02-26T10:18:11,432 adding 'moleculekit/share/pdb2pqr/residues/HLU.xml' 2024-02-26T10:18:11,433 adding 'moleculekit/share/pdb2pqr/residues/HLX.dat' 2024-02-26T10:18:11,434 adding 'moleculekit/share/pdb2pqr/residues/HLX.xml' 2024-02-26T10:18:11,435 adding 'moleculekit/share/pdb2pqr/residues/HOX.dat' 2024-02-26T10:18:11,437 adding 'moleculekit/share/pdb2pqr/residues/HOX.xml' 2024-02-26T10:18:11,438 adding 'moleculekit/share/pdb2pqr/residues/HPE.dat' 2024-02-26T10:18:11,439 adding 'moleculekit/share/pdb2pqr/residues/HPE.xml' 2024-02-26T10:18:11,440 adding 'moleculekit/share/pdb2pqr/residues/HQA.dat' 2024-02-26T10:18:11,442 adding 'moleculekit/share/pdb2pqr/residues/HQA.xml' 2024-02-26T10:18:11,443 adding 'moleculekit/share/pdb2pqr/residues/HTR.dat' 2024-02-26T10:18:11,444 adding 'moleculekit/share/pdb2pqr/residues/HTR.xml' 2024-02-26T10:18:11,445 adding 'moleculekit/share/pdb2pqr/residues/HYP.dat' 2024-02-26T10:18:11,447 adding 'moleculekit/share/pdb2pqr/residues/HYP.xml' 2024-02-26T10:18:11,448 adding 'moleculekit/share/pdb2pqr/residues/I2M.dat' 2024-02-26T10:18:11,449 adding 'moleculekit/share/pdb2pqr/residues/I2M.xml' 2024-02-26T10:18:11,450 adding 'moleculekit/share/pdb2pqr/residues/IGL.dat' 2024-02-26T10:18:11,452 adding 'moleculekit/share/pdb2pqr/residues/IGL.xml' 2024-02-26T10:18:11,453 adding 'moleculekit/share/pdb2pqr/residues/IIL.dat' 2024-02-26T10:18:11,454 adding 'moleculekit/share/pdb2pqr/residues/IIL.xml' 2024-02-26T10:18:11,456 adding 'moleculekit/share/pdb2pqr/residues/IML.dat' 2024-02-26T10:18:11,457 adding 'moleculekit/share/pdb2pqr/residues/IML.xml' 2024-02-26T10:18:11,458 adding 'moleculekit/share/pdb2pqr/residues/KYN.dat' 2024-02-26T10:18:11,459 adding 'moleculekit/share/pdb2pqr/residues/KYN.xml' 2024-02-26T10:18:11,460 adding 'moleculekit/share/pdb2pqr/residues/LME.dat' 2024-02-26T10:18:11,462 adding 'moleculekit/share/pdb2pqr/residues/LME.xml' 2024-02-26T10:18:11,463 adding 'moleculekit/share/pdb2pqr/residues/LMQ.dat' 2024-02-26T10:18:11,464 adding 'moleculekit/share/pdb2pqr/residues/LMQ.xml' 2024-02-26T10:18:11,465 adding 'moleculekit/share/pdb2pqr/residues/LYZ.dat' 2024-02-26T10:18:11,467 adding 'moleculekit/share/pdb2pqr/residues/LYZ.xml' 2024-02-26T10:18:11,468 adding 'moleculekit/share/pdb2pqr/residues/M3L.dat' 2024-02-26T10:18:11,469 adding 'moleculekit/share/pdb2pqr/residues/M3L.xml' 2024-02-26T10:18:11,470 adding 'moleculekit/share/pdb2pqr/residues/ME0.dat' 2024-02-26T10:18:11,471 adding 'moleculekit/share/pdb2pqr/residues/ME0.xml' 2024-02-26T10:18:11,472 adding 'moleculekit/share/pdb2pqr/residues/MEA.dat' 2024-02-26T10:18:11,473 adding 'moleculekit/share/pdb2pqr/residues/MEA.xml' 2024-02-26T10:18:11,474 adding 'moleculekit/share/pdb2pqr/residues/MEN.dat' 2024-02-26T10:18:11,476 adding 'moleculekit/share/pdb2pqr/residues/MEN.xml' 2024-02-26T10:18:11,477 adding 'moleculekit/share/pdb2pqr/residues/MEQ.dat' 2024-02-26T10:18:11,478 adding 'moleculekit/share/pdb2pqr/residues/MEQ.xml' 2024-02-26T10:18:11,479 adding 'moleculekit/share/pdb2pqr/residues/MLE.dat' 2024-02-26T10:18:11,480 adding 'moleculekit/share/pdb2pqr/residues/MLE.xml' 2024-02-26T10:18:11,482 adding 'moleculekit/share/pdb2pqr/residues/MLY.dat' 2024-02-26T10:18:11,483 adding 'moleculekit/share/pdb2pqr/residues/MLY.xml' 2024-02-26T10:18:11,484 adding 'moleculekit/share/pdb2pqr/residues/MLZ.dat' 2024-02-26T10:18:11,485 adding 'moleculekit/share/pdb2pqr/residues/MLZ.xml' 2024-02-26T10:18:11,486 adding 'moleculekit/share/pdb2pqr/residues/MME.dat' 2024-02-26T10:18:11,487 adding 'moleculekit/share/pdb2pqr/residues/MME.xml' 2024-02-26T10:18:11,488 adding 'moleculekit/share/pdb2pqr/residues/MMO.dat' 2024-02-26T10:18:11,490 adding 'moleculekit/share/pdb2pqr/residues/MMO.xml' 2024-02-26T10:18:11,491 adding 'moleculekit/share/pdb2pqr/residues/MVA.dat' 2024-02-26T10:18:11,492 adding 'moleculekit/share/pdb2pqr/residues/MVA.xml' 2024-02-26T10:18:11,493 adding 'moleculekit/share/pdb2pqr/residues/NAL.dat' 2024-02-26T10:18:11,494 adding 'moleculekit/share/pdb2pqr/residues/NAL.xml' 2024-02-26T10:18:11,496 adding 'moleculekit/share/pdb2pqr/residues/NCY.dat' 2024-02-26T10:18:11,497 adding 'moleculekit/share/pdb2pqr/residues/NCY.xml' 2024-02-26T10:18:11,498 adding 'moleculekit/share/pdb2pqr/residues/NLE.dat' 2024-02-26T10:18:11,499 adding 'moleculekit/share/pdb2pqr/residues/NLE.xml' 2024-02-26T10:18:11,500 adding 'moleculekit/share/pdb2pqr/residues/NVA.dat' 2024-02-26T10:18:11,502 adding 'moleculekit/share/pdb2pqr/residues/NVA.xml' 2024-02-26T10:18:11,503 adding 'moleculekit/share/pdb2pqr/residues/NZC.dat' 2024-02-26T10:18:11,504 adding 'moleculekit/share/pdb2pqr/residues/NZC.xml' 2024-02-26T10:18:11,505 adding 'moleculekit/share/pdb2pqr/residues/OCY.dat' 2024-02-26T10:18:11,506 adding 'moleculekit/share/pdb2pqr/residues/OCY.xml' 2024-02-26T10:18:11,508 adding 'moleculekit/share/pdb2pqr/residues/OMX.dat' 2024-02-26T10:18:11,509 adding 'moleculekit/share/pdb2pqr/residues/OMX.xml' 2024-02-26T10:18:11,510 adding 'moleculekit/share/pdb2pqr/residues/ONL.dat' 2024-02-26T10:18:11,511 adding 'moleculekit/share/pdb2pqr/residues/ONL.xml' 2024-02-26T10:18:11,513 adding 'moleculekit/share/pdb2pqr/residues/ORM.dat' 2024-02-26T10:18:11,514 adding 'moleculekit/share/pdb2pqr/residues/ORM.xml' 2024-02-26T10:18:11,515 adding 'moleculekit/share/pdb2pqr/residues/P1L.dat' 2024-02-26T10:18:11,517 adding 'moleculekit/share/pdb2pqr/residues/P1L.xml' 2024-02-26T10:18:11,518 adding 'moleculekit/share/pdb2pqr/residues/PCA.dat' 2024-02-26T10:18:11,519 adding 'moleculekit/share/pdb2pqr/residues/PCA.xml' 2024-02-26T10:18:11,520 adding 'moleculekit/share/pdb2pqr/residues/PRK.dat' 2024-02-26T10:18:11,522 adding 'moleculekit/share/pdb2pqr/residues/PRK.xml' 2024-02-26T10:18:11,523 adding 'moleculekit/share/pdb2pqr/residues/PTR.dat' 2024-02-26T10:18:11,524 adding 'moleculekit/share/pdb2pqr/residues/PTR.xml' 2024-02-26T10:18:11,526 adding 'moleculekit/share/pdb2pqr/residues/SEP.dat' 2024-02-26T10:18:11,527 adding 'moleculekit/share/pdb2pqr/residues/SEP.xml' 2024-02-26T10:18:11,528 adding 'moleculekit/share/pdb2pqr/residues/TPO.dat' 2024-02-26T10:18:11,529 adding 'moleculekit/share/pdb2pqr/residues/TPO.xml' 2024-02-26T10:18:11,530 adding 'moleculekit/share/pdb2pqr/residues/TRO.dat' 2024-02-26T10:18:11,531 adding 'moleculekit/share/pdb2pqr/residues/TRO.xml' 2024-02-26T10:18:11,533 adding 'moleculekit/share/pdb2pqr/residues/TY2.dat' 2024-02-26T10:18:11,534 adding 'moleculekit/share/pdb2pqr/residues/TY2.xml' 2024-02-26T10:18:11,535 adding 'moleculekit/share/pdb2pqr/residues/TYQ.dat' 2024-02-26T10:18:11,536 adding 'moleculekit/share/pdb2pqr/residues/TYQ.xml' 2024-02-26T10:18:11,537 adding 'moleculekit/share/pdb2pqr/residues/YCM.dat' 2024-02-26T10:18:11,538 adding 'moleculekit/share/pdb2pqr/residues/YCM.xml' 2024-02-26T10:18:11,539 adding 'moleculekit/share/pdb2pqr/residues/YNM.dat' 2024-02-26T10:18:11,541 adding 'moleculekit/share/pdb2pqr/residues/YNM.xml' 2024-02-26T10:18:11,542 adding 'moleculekit/smallmol/__init__.py' 2024-02-26T10:18:11,547 adding 'moleculekit/smallmol/smallmol.py' 2024-02-26T10:18:11,550 adding 'moleculekit/smallmol/smallmollib.py' 2024-02-26T10:18:11,551 adding 'moleculekit/smallmol/test_smallmol.py' 2024-02-26T10:18:11,553 adding 'moleculekit/smallmol/test_smallmollib.py' 2024-02-26T10:18:11,555 adding 'moleculekit/smallmol/util.py' 2024-02-26T10:18:11,557 adding 'moleculekit/smallmol/tools/__init__.py' 2024-02-26T10:18:11,559 adding 'moleculekit/smallmol/tools/clustering.py' 2024-02-26T10:18:11,560 adding 'moleculekit/smallmol/tools/restrainedembed.py' 2024-02-26T10:18:11,562 adding 'moleculekit/smallmol/tools/test_tools.py' 2024-02-26T10:18:11,651 adding 'moleculekit/tmalign/tmalign_util.cpp' 2024-02-26T10:18:11,659 adding 'moleculekit/tmalign/tmalign_util.pyx' 2024-02-26T10:18:11,661 adding 'moleculekit/tmalign/tmalignlib.pxd' 2024-02-26T10:18:11,662 adding 'moleculekit/tmalign/include/TMAlign.h' 2024-02-26T10:18:11,679 adding 'moleculekit/tmalign/src/TMAlign.cpp' 2024-02-26T10:18:11,682 adding 'moleculekit/tools/__init__.py' 2024-02-26T10:18:11,684 adding 'moleculekit/tools/atomtyper.py' 2024-02-26T10:18:11,686 adding 'moleculekit/tools/autosegment.py' 2024-02-26T10:18:11,688 adding 'moleculekit/tools/crystalpacking.py' 2024-02-26T10:18:11,692 adding 'moleculekit/tools/detect.py' 2024-02-26T10:18:11,694 adding 'moleculekit/tools/docking.py' 2024-02-26T10:18:11,695 adding 'moleculekit/tools/graphalignment.py' 2024-02-26T10:18:11,697 adding 'moleculekit/tools/hhblitsprofile.py' 2024-02-26T10:18:11,698 adding 'moleculekit/tools/modelling.py' 2024-02-26T10:18:11,700 adding 'moleculekit/tools/moleculechecks.py' 2024-02-26T10:18:11,706 adding 'moleculekit/tools/preparation.py' 2024-02-26T10:18:11,709 adding 'moleculekit/tools/preparation_customres.py' 2024-02-26T10:18:11,710 adding 'moleculekit/tools/sequencestructuralalignment.py' 2024-02-26T10:18:11,713 adding 'moleculekit/tools/voxeldescriptors.py' 2024-02-26T10:18:11,715 adding 'moleculekit/tools/obabel_tools/__init__.py' 2024-02-26T10:18:11,717 adding 'moleculekit/tools/obabel_tools/obabel_cli.py' 2024-02-26T10:18:11,808 adding 'moleculekit/wrapping/wrapping.cpp' 2024-02-26T10:18:11,817 adding 'moleculekit/wrapping/wrapping.pyx' 2024-02-26T10:18:11,819 adding 'moleculekit-1.8.24.dist-info/LICENSE' 2024-02-26T10:18:11,820 adding 'moleculekit-1.8.24.dist-info/METADATA' 2024-02-26T10:18:11,821 adding 'moleculekit-1.8.24.dist-info/WHEEL' 2024-02-26T10:18:11,822 adding 'moleculekit-1.8.24.dist-info/top_level.txt' 2024-02-26T10:18:11,827 adding 'moleculekit-1.8.24.dist-info/RECORD' 2024-02-26T10:18:11,987 removing build/bdist.linux-armv7l/wheel 2024-02-26T10:18:12,289 Building wheel for moleculekit (pyproject.toml): finished with status 'done' 2024-02-26T10:18:12,617 Created wheel for moleculekit: filename=moleculekit-1.8.24-cp311-cp311-linux_armv7l.whl size=15251600 sha256=4c7c0ad147877ad9858b28bbf91bac3c9c52fc1b86d17b5cbb395816826d5795 2024-02-26T10:18:12,618 Stored in directory: /tmp/pip-ephem-wheel-cache-3xuuhfjv/wheels/96/5e/e4/24c4d08789c91163e551825b8ccdcea91d274662ab1f2f83ce 2024-02-26T10:18:12,644 Successfully built moleculekit 2024-02-26T10:18:13,008 Removed build tracker: '/tmp/pip-build-tracker-fyvwymmw'