2024-04-19T11:38:14,377 Created temporary directory: /tmp/pip-build-tracker-d5655o44 2024-04-19T11:38:14,378 Initialized build tracking at /tmp/pip-build-tracker-d5655o44 2024-04-19T11:38:14,378 Created build tracker: /tmp/pip-build-tracker-d5655o44 2024-04-19T11:38:14,379 Entered build tracker: /tmp/pip-build-tracker-d5655o44 2024-04-19T11:38:14,379 Created temporary directory: /tmp/pip-wheel-cbpd4337 2024-04-19T11:38:14,383 Created temporary directory: /tmp/pip-ephem-wheel-cache-lb1amqou 2024-04-19T11:38:14,404 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-04-19T11:38:14,408 2 location(s) to search for versions of moleculekit: 2024-04-19T11:38:14,408 * https://pypi.org/simple/moleculekit/ 2024-04-19T11:38:14,408 * https://www.piwheels.org/simple/moleculekit/ 2024-04-19T11:38:14,409 Fetching project page and analyzing links: https://pypi.org/simple/moleculekit/ 2024-04-19T11:38:14,409 Getting page https://pypi.org/simple/moleculekit/ 2024-04-19T11:38:14,411 Found index url https://pypi.org/simple/ 2024-04-19T11:38:14,653 Fetched page https://pypi.org/simple/moleculekit/ as application/vnd.pypi.simple.v1+json 2024-04-19T11:38:14,697 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/) 2024-04-19T11:38:14,697 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 2024-04-19T11:38:14,698 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/) 2024-04-19T11:38:14,699 Found link 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(from https://www.piwheels.org/simple/moleculekit/) 2024-04-19T11:38:15,357 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.17-py3-none-any.whl#sha256=cd99998c6c3ee48df7148cec7161f3696beede842d4e93bb9da19fa9e2c6c459 (from https://www.piwheels.org/simple/moleculekit/) 2024-04-19T11:38:15,358 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.16-py3-none-any.whl#sha256=8045990a2fc7c805a4ab8244abe9eae67ac92495cbce12f1c9e8b0daa26a77b1 (from https://www.piwheels.org/simple/moleculekit/) 2024-04-19T11:38:15,359 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.15-py3-none-any.whl#sha256=4db5d8b5350b36ce41d225c471f0fdd64f708826935ac50675fb278c00275339 (from https://www.piwheels.org/simple/moleculekit/) 2024-04-19T11:38:15,360 Skipping link: No binaries permitted for moleculekit: 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(from https://www.piwheels.org/simple/moleculekit/) 2024-04-19T11:38:15,361 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.7-py3-none-any.whl#sha256=899ef09b80e1ad2e3931cb2023fae09cfeecd45b83fade6c8e8739126ca67a20 (from https://www.piwheels.org/simple/moleculekit/) 2024-04-19T11:38:15,362 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.6-py3-none-any.whl#sha256=0a288cd1efd660482dcc967caed02315dd8f02c19a0287eee0b8519d761db1b3 (from https://www.piwheels.org/simple/moleculekit/) 2024-04-19T11:38:15,363 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.5-py3-none-any.whl#sha256=2f111e31b3f90e63ca0154c528585208b8bd41a065aa0078325683f4b36eacec (from https://www.piwheels.org/simple/moleculekit/) 2024-04-19T11:38:15,363 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.4-py3-none-any.whl#sha256=5784491ff294e145a00311f8239aaa0b92c12605db0508ee3e10469b80d4cadd (from https://www.piwheels.org/simple/moleculekit/) 2024-04-19T11:38:15,364 Skipping link: not a file: https://www.piwheels.org/simple/moleculekit/ 2024-04-19T11:38:15,365 Skipping link: not a file: https://pypi.org/simple/moleculekit/ 2024-04-19T11:38:15,405 Given no hashes to check 1 links for project 'moleculekit': discarding no candidates 2024-04-19T11:38:15,424 Collecting moleculekit==1.8.31 2024-04-19T11:38:15,426 Created temporary directory: /tmp/pip-unpack-_6w9ev_v 2024-04-19T11:38:15,744 Downloading moleculekit-1.8.31.tar.gz (6.8 MB) 2024-04-19T11:38:18,397 Added moleculekit==1.8.31 from https://files.pythonhosted.org/packages/d6/e2/f7f2b1870c62092c3d84ac0055b50305611a1253142cb592babdfcbdb266/moleculekit-1.8.31.tar.gz to build tracker '/tmp/pip-build-tracker-d5655o44' 2024-04-19T11:38:18,406 Created temporary directory: /tmp/pip-build-env-ot2ws_un 2024-04-19T11:38:18,410 Installing build dependencies: started 2024-04-19T11:38:18,411 Running command pip subprocess to install build dependencies 2024-04-19T11:38:19,536 Using pip 24.0 from /usr/local/lib/python3.11/dist-packages/pip (python 3.11) 2024-04-19T11:38:20,035 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-04-19T11:38:21,561 Collecting setuptools 2024-04-19T11:38:21,577 Using cached https://www.piwheels.org/simple/setuptools/setuptools-69.5.1-py3-none-any.whl (894 kB) 2024-04-19T11:38:22,236 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) 2024-04-19T11:38:22,240 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) 2024-04-19T11:38:22,243 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) 2024-04-19T11:38:22,246 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) 2024-04-19T11:38:22,249 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) 2024-04-19T11:38:22,526 Collecting numpy>=1.18.5 2024-04-19T11:38:22,552 Using cached https://www.piwheels.org/simple/numpy/numpy-1.26.4-cp311-cp311-linux_armv7l.whl (5.6 MB) 2024-04-19T11:38:23,998 Collecting Cython>=0.29.21 2024-04-19T11:38:24,014 Using cached https://www.piwheels.org/simple/cython/Cython-3.0.10-cp311-cp311-linux_armv7l.whl (11.8 MB) 2024-04-19T11:38:24,412 Collecting toml 2024-04-19T11:38:24,427 Using cached https://www.piwheels.org/simple/toml/toml-0.10.2-py2.py3-none-any.whl (16 kB) 2024-04-19T11:38:24,600 Collecting versioneer==0.28 (from versioneer[toml]==0.28) 2024-04-19T11:38:24,617 Using cached https://www.piwheels.org/simple/versioneer/versioneer-0.28-py3-none-any.whl (45 kB) 2024-04-19T11:38:27,258 Installing collected packages: versioneer, toml, setuptools, numpy, Cython 2024-04-19T11:38:27,289 Creating /tmp/pip-build-env-ot2ws_un/overlay/local/bin 2024-04-19T11:38:27,291 changing mode of /tmp/pip-build-env-ot2ws_un/overlay/local/bin/versioneer to 755 2024-04-19T11:38:37,923 changing mode of /tmp/pip-build-env-ot2ws_un/overlay/local/bin/f2py to 755 2024-04-19T11:38:41,526 changing mode of /tmp/pip-build-env-ot2ws_un/overlay/local/bin/cygdb to 755 2024-04-19T11:38:41,528 changing mode of /tmp/pip-build-env-ot2ws_un/overlay/local/bin/cython to 755 2024-04-19T11:38:41,530 changing mode of /tmp/pip-build-env-ot2ws_un/overlay/local/bin/cythonize to 755 2024-04-19T11:38:41,575 Successfully installed Cython-3.0.10 numpy-1.26.4 setuptools-69.5.1 toml-0.10.2 versioneer-0.28 2024-04-19T11:38:42,246 Installing build dependencies: finished with status 'done' 2024-04-19T11:38:42,249 Getting requirements to build wheel: started 2024-04-19T11:38:42,251 Running command Getting requirements to build wheel 2024-04-19T11:39:17,800 warning: moleculekit/wrapping/wrapping.pyx:47:4: Unreachable code 2024-04-19T11:39:26,169 Compiling moleculekit/interactions/hbonds/hbonds.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,170 Compiling moleculekit/interactions/pipi/pipi.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,170 Compiling moleculekit/interactions/cationpi/cationpi.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,171 Compiling moleculekit/interactions/sigmahole/sigmahole.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,171 Compiling moleculekit/wrapping/wrapping.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,172 Compiling moleculekit/bondguesser_utils/bondguesser_utils.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,173 Compiling moleculekit/atomselect_utils/atomselect_utils.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,173 Compiling moleculekit/distance_utils/distance_utils.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,173 Compiling moleculekit/occupancy_utils/occupancy_utils.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,174 Compiling moleculekit/cython_utils/cython_utils.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,174 Compiling moleculekit/fileformats/xtc/xtc.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-04-19T11:39:26,175 Compiling moleculekit/fileformats/xtc/trr.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-04-19T11:39:26,175 Compiling moleculekit/fileformats/dcd/dcd.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-04-19T11:39:26,176 Compiling moleculekit/fileformats/binpos/binpos.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libc/string.pxd. 2024-04-19T11:39:26,176 Compiling moleculekit/tmalign/tmalign_util.pyx because it depends on /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/Cython/Includes/libcpp/vector.pxd. 2024-04-19T11:39:26,177 [ 1/15] Cythonizing moleculekit/atomselect_utils/atomselect_utils.pyx 2024-04-19T11:39:26,177 [ 2/15] Cythonizing moleculekit/bondguesser_utils/bondguesser_utils.pyx 2024-04-19T11:39:26,178 [ 3/15] Cythonizing moleculekit/cython_utils/cython_utils.pyx 2024-04-19T11:39:26,178 [ 4/15] Cythonizing moleculekit/distance_utils/distance_utils.pyx 2024-04-19T11:39:26,179 [ 5/15] Cythonizing moleculekit/fileformats/dcd/dcd.pyx 2024-04-19T11:39:26,179 [ 6/15] Cythonizing moleculekit/interactions/cationpi/cationpi.pyx 2024-04-19T11:39:26,180 [ 7/15] Cythonizing moleculekit/interactions/hbonds/hbonds.pyx 2024-04-19T11:39:26,180 [ 8/15] Cythonizing moleculekit/interactions/pipi/pipi.pyx 2024-04-19T11:39:26,181 [ 9/15] Cythonizing moleculekit/interactions/sigmahole/sigmahole.pyx 2024-04-19T11:39:26,181 [10/15] Cythonizing moleculekit/occupancy_utils/occupancy_utils.pyx 2024-04-19T11:39:26,182 [11/15] Cythonizing moleculekit/tmalign/tmalign_util.pyx 2024-04-19T11:39:26,182 [12/15] Cythonizing moleculekit/wrapping/wrapping.pyx 2024-04-19T11:39:26,183 [13/15] Cythonizing moleculekit/fileformats/binpos/binpos.pyx 2024-04-19T11:39:26,184 [14/15] Cythonizing moleculekit/fileformats/xtc/trr.pyx 2024-04-19T11:39:26,184 [15/15] Cythonizing moleculekit/fileformats/xtc/xtc.pyx 2024-04-19T11:39:26,455 running egg_info 2024-04-19T11:39:26,462 writing moleculekit.egg-info/PKG-INFO 2024-04-19T11:39:26,465 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-04-19T11:39:26,468 writing requirements to moleculekit.egg-info/requires.txt 2024-04-19T11:39:26,470 writing top-level names to moleculekit.egg-info/top_level.txt 2024-04-19T11:39:26,498 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,499 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,500 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,500 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,501 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,501 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,502 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,503 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,503 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,504 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,504 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,505 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,505 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,506 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:26,507 dependency 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2024-04-19T11:39:26,850 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-04-19T11:39:28,516 Getting requirements to build wheel: finished with status 'done' 2024-04-19T11:39:28,529 Installing backend dependencies: started 2024-04-19T11:39:28,530 Running command pip subprocess to install backend dependencies 2024-04-19T11:39:29,768 Using pip 24.0 from /usr/local/lib/python3.11/dist-packages/pip (python 3.11) 2024-04-19T11:39:30,301 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-04-19T11:39:31,050 Collecting wheel 2024-04-19T11:39:31,065 Using cached https://www.piwheels.org/simple/wheel/wheel-0.43.0-py3-none-any.whl (65 kB) 2024-04-19T11:39:33,314 Installing collected packages: wheel 2024-04-19T11:39:33,534 Creating /tmp/pip-build-env-ot2ws_un/normal/local/bin 2024-04-19T11:39:33,536 changing mode of /tmp/pip-build-env-ot2ws_un/normal/local/bin/wheel to 755 2024-04-19T11:39:33,547 Successfully installed wheel-0.43.0 2024-04-19T11:39:33,997 Installing backend dependencies: finished with status 'done' 2024-04-19T11:39:33,999 Created temporary directory: /tmp/pip-modern-metadata-icqagq4r 2024-04-19T11:39:34,001 Preparing metadata (pyproject.toml): started 2024-04-19T11:39:34,002 Running command Preparing metadata (pyproject.toml) 2024-04-19T11:39:36,411 running dist_info 2024-04-19T11:39:36,413 creating /tmp/pip-modern-metadata-icqagq4r/moleculekit.egg-info 2024-04-19T11:39:36,418 writing /tmp/pip-modern-metadata-icqagq4r/moleculekit.egg-info/PKG-INFO 2024-04-19T11:39:36,422 writing dependency_links to /tmp/pip-modern-metadata-icqagq4r/moleculekit.egg-info/dependency_links.txt 2024-04-19T11:39:36,424 writing requirements to /tmp/pip-modern-metadata-icqagq4r/moleculekit.egg-info/requires.txt 2024-04-19T11:39:36,425 writing top-level names to /tmp/pip-modern-metadata-icqagq4r/moleculekit.egg-info/top_level.txt 2024-04-19T11:39:36,426 writing manifest file '/tmp/pip-modern-metadata-icqagq4r/moleculekit.egg-info/SOURCES.txt' 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/tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,471 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,472 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,473 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,473 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,474 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,474 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,475 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,476 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,476 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,477 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,477 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,478 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,479 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,479 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,479 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,480 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,480 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,481 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,481 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,482 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,482 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,483 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,483 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,484 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,484 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,484 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,485 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,485 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,486 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,486 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,487 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,488 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,488 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,488 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,489 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,489 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,490 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,490 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,491 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,491 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,491 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,492 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,492 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:36,493 reading manifest file '/tmp/pip-modern-metadata-icqagq4r/moleculekit.egg-info/SOURCES.txt' 2024-04-19T11:39:36,493 reading manifest template 'MANIFEST.in' 2024-04-19T11:39:36,742 no previously-included directories found matching 'moleculekit/test-data' 2024-04-19T11:39:36,743 no previously-included directories found matching 'moleculekit/tests' 2024-04-19T11:39:36,744 no previously-included directories found matching 'package' 2024-04-19T11:39:36,744 adding license file 'LICENSE' 2024-04-19T11:39:36,756 writing manifest file '/tmp/pip-modern-metadata-icqagq4r/moleculekit.egg-info/SOURCES.txt' 2024-04-19T11:39:36,764 creating '/tmp/pip-modern-metadata-icqagq4r/moleculekit-1.8.31.dist-info' 2024-04-19T11:39:37,000 Preparing metadata (pyproject.toml): finished with status 'done' 2024-04-19T11:39:37,005 Source in /tmp/pip-wheel-cbpd4337/moleculekit_d6a317309c1949f9975cbd386461ac3c has version 1.8.31, which satisfies requirement moleculekit==1.8.31 from https://files.pythonhosted.org/packages/d6/e2/f7f2b1870c62092c3d84ac0055b50305611a1253142cb592babdfcbdb266/moleculekit-1.8.31.tar.gz 2024-04-19T11:39:37,006 Removed moleculekit==1.8.31 from https://files.pythonhosted.org/packages/d6/e2/f7f2b1870c62092c3d84ac0055b50305611a1253142cb592babdfcbdb266/moleculekit-1.8.31.tar.gz from build tracker '/tmp/pip-build-tracker-d5655o44' 2024-04-19T11:39:37,012 Created temporary directory: /tmp/pip-unpack-b0_943nu 2024-04-19T11:39:37,013 Created temporary directory: /tmp/pip-unpack-26fjhi5g 2024-04-19T11:39:37,020 Building wheels for collected packages: moleculekit 2024-04-19T11:39:37,025 Created temporary directory: /tmp/pip-wheel-har0ro7r 2024-04-19T11:39:37,025 Destination directory: /tmp/pip-wheel-har0ro7r 2024-04-19T11:39:37,027 Building wheel for moleculekit (pyproject.toml): started 2024-04-19T11:39:37,028 Running command Building wheel for moleculekit (pyproject.toml) 2024-04-19T11:39:39,274 running bdist_wheel 2024-04-19T11:39:39,288 running build 2024-04-19T11:39:39,289 running build_py 2024-04-19T11:39:39,295 creating build 2024-04-19T11:39:39,296 creating build/lib.linux-armv7l-cpython-311 2024-04-19T11:39:39,296 creating build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,297 copying moleculekit/bondguesser.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,300 copying moleculekit/version.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,301 copying moleculekit/vmdgraphics.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,303 copying moleculekit/dihedral.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,305 copying moleculekit/rdkitintegration.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,307 copying moleculekit/vmdviewer.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,309 copying moleculekit/util.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,311 copying moleculekit/molecule.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,315 copying moleculekit/rcsb.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,317 copying moleculekit/pymolgraphics.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,319 copying moleculekit/opm.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,321 copying moleculekit/viewer.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,323 copying moleculekit/distance.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,325 copying moleculekit/align.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,327 copying moleculekit/_version.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,328 copying moleculekit/config.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,330 copying moleculekit/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,331 copying moleculekit/readers.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,335 copying moleculekit/writers.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,339 copying moleculekit/periodictable.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,341 copying moleculekit/home.py -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:39,343 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-04-19T11:39:39,344 copying moleculekit/fileformats/utils.py -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-04-19T11:39:39,347 copying moleculekit/fileformats/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-04-19T11:39:39,348 copying moleculekit/fileformats/netcdf.py -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats 2024-04-19T11:39:39,352 creating build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,353 copying moleculekit/projections/metricgyration.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,355 copying moleculekit/projections/util.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,357 copying moleculekit/projections/metriccoordinate.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,359 copying moleculekit/projections/metricsasa.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,361 copying moleculekit/projections/metricfluctuation.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,363 copying moleculekit/projections/metricsecondarystructure.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,365 copying moleculekit/projections/metrictmscore.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,367 copying moleculekit/projections/metricplumed2.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,370 copying moleculekit/projections/metricshell.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,372 copying moleculekit/projections/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,373 copying moleculekit/projections/projection.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,375 copying moleculekit/projections/metricdihedral.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,377 copying moleculekit/projections/metricdistance.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,380 copying moleculekit/projections/metricrmsd.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,382 copying moleculekit/projections/metricsphericalcoordinate.py -> build/lib.linux-armv7l-cpython-311/moleculekit/projections 2024-04-19T11:39:39,385 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions 2024-04-19T11:39:39,386 copying moleculekit/interactions/interactions.py -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions 2024-04-19T11:39:39,389 copying moleculekit/interactions/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions 2024-04-19T11:39:39,391 creating build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-04-19T11:39:39,392 copying moleculekit/atomselect/atomselect.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-04-19T11:39:39,394 copying moleculekit/atomselect/analyze.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-04-19T11:39:39,396 copying moleculekit/atomselect/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-04-19T11:39:39,398 copying moleculekit/atomselect/languageparser.py -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect 2024-04-19T11:39:39,400 creating build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-04-19T11:39:39,401 copying moleculekit/smallmol/test_smallmollib.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-04-19T11:39:39,404 copying moleculekit/smallmol/smallmolcdp.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-04-19T11:39:39,406 copying moleculekit/smallmol/util.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-04-19T11:39:39,408 copying moleculekit/smallmol/test_smallmol.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-04-19T11:39:39,410 copying moleculekit/smallmol/smallmol.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-04-19T11:39:39,413 copying moleculekit/smallmol/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-04-19T11:39:39,415 copying moleculekit/smallmol/smallmollib.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol 2024-04-19T11:39:39,418 creating build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,419 copying moleculekit/tools/autosegment.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,422 copying moleculekit/tools/preparation_customres.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,424 copying moleculekit/tools/docking.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,426 copying moleculekit/tools/voxeldescriptors.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,428 copying moleculekit/tools/modelling.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,431 copying moleculekit/tools/graphalignment.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,433 copying moleculekit/tools/crystalpacking.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,435 copying moleculekit/tools/preparation.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,438 copying moleculekit/tools/moleculechecks.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,440 copying moleculekit/tools/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,441 copying moleculekit/tools/sequencestructuralalignment.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,443 copying moleculekit/tools/detect.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,446 copying moleculekit/tools/hhblitsprofile.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,448 copying moleculekit/tools/atomtyper.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools 2024-04-19T11:39:39,451 creating build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-04-19T11:39:39,451 copying moleculekit/ply/lex.py -> build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-04-19T11:39:39,454 copying moleculekit/ply/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-04-19T11:39:39,456 copying moleculekit/ply/yacc.py -> build/lib.linux-armv7l-cpython-311/moleculekit/ply 2024-04-19T11:39:39,460 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx 2024-04-19T11:39:39,461 copying moleculekit/pdbx/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx 2024-04-19T11:39:39,463 creating build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-04-19T11:39:39,464 copying moleculekit/smallmol/tools/restrainedembed.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-04-19T11:39:39,465 copying moleculekit/smallmol/tools/clustering.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-04-19T11:39:39,468 copying moleculekit/smallmol/tools/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-04-19T11:39:39,469 copying moleculekit/smallmol/tools/test_tools.py -> build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools 2024-04-19T11:39:39,472 creating build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools 2024-04-19T11:39:39,473 copying moleculekit/tools/obabel_tools/obabel_cli.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools 2024-04-19T11:39:39,475 copying moleculekit/tools/obabel_tools/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools 2024-04-19T11:39:39,477 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer 2024-04-19T11:39:39,478 copying moleculekit/pdbx/writer/PdbxWriter.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer 2024-04-19T11:39:39,480 copying moleculekit/pdbx/writer/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer 2024-04-19T11:39:39,482 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-04-19T11:39:39,483 copying moleculekit/pdbx/tests/PdbxWriterTests.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-04-19T11:39:39,485 copying moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-04-19T11:39:39,487 copying moleculekit/pdbx/tests/PdbxReaderTests.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-04-19T11:39:39,489 copying moleculekit/pdbx/tests/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests 2024-04-19T11:39:39,491 creating build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-04-19T11:39:39,492 copying moleculekit/pdbx/reader/PdbxReader.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-04-19T11:39:39,494 copying moleculekit/pdbx/reader/PdbxParser.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-04-19T11:39:39,496 copying moleculekit/pdbx/reader/__init__.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-04-19T11:39:39,498 copying moleculekit/pdbx/reader/PdbxContainers.py -> build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader 2024-04-19T11:39:39,500 running egg_info 2024-04-19T11:39:39,505 writing moleculekit.egg-info/PKG-INFO 2024-04-19T11:39:39,508 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-04-19T11:39:39,509 writing requirements to moleculekit.egg-info/requires.txt 2024-04-19T11:39:39,510 writing top-level names to moleculekit.egg-info/top_level.txt 2024-04-19T11:39:39,527 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,527 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,528 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,529 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,529 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,530 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,530 dependency 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be automatically included in the manifest: the path must be relative 2024-04-19T11:39:39,533 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,534 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,534 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,535 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,536 dependency 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/tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,541 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,541 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,542 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,542 dependency /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h won't 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/tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,565 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,565 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,566 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,566 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,567 dependency /tmp/pip-build-env-ot2ws_un/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 2024-04-19T11:39:39,567 reading manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-04-19T11:39:39,568 reading manifest template 'MANIFEST.in' 2024-04-19T11:39:39,797 no previously-included directories found matching 'moleculekit/test-data' 2024-04-19T11:39:39,798 no previously-included directories found matching 'moleculekit/tests' 2024-04-19T11:39:39,799 no previously-included directories found matching 'package' 2024-04-19T11:39:39,800 adding license file 'LICENSE' 2024-04-19T11:39:39,814 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-04-19T11:39:39,823 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.atomselect_utils' is absent from the `packages` configuration. 2024-04-19T11:39:39,824 !! 2024-04-19T11:39:39,825 ******************************************************************************** 2024-04-19T11:39:39,826 ############################ 2024-04-19T11:39:39,827 # Package would be ignored # 2024-04-19T11:39:39,828 ############################ 2024-04-19T11:39:39,828 Python recognizes 'moleculekit.atomselect_utils' as an importable package[^1], 2024-04-19T11:39:39,829 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:39,830 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:39,831 package, please make sure that 'moleculekit.atomselect_utils' is explicitly added 2024-04-19T11:39:39,831 to the `packages` configuration field. 2024-04-19T11:39:39,832 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:39,833 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:39,833 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:39,834 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:39,836 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:39,837 If you don't want 'moleculekit.atomselect_utils' to be distributed and are 2024-04-19T11:39:39,837 already explicitly excluding 'moleculekit.atomselect_utils' via 2024-04-19T11:39:39,838 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:39,838 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:39,839 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:39,840 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:39,841 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:39,842 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:39,842 even if it does not contain any `.py` files. 2024-04-19T11:39:39,842 On the other hand, currently there is no concept of package data 2024-04-19T11:39:39,843 directory, all directories are treated like packages. 2024-04-19T11:39:39,843 ******************************************************************************** 2024-04-19T11:39:39,844 !! 2024-04-19T11:39:39,844 check.warn(importable) 2024-04-19T11:39:39,844 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.bondguesser_utils' is absent from the `packages` configuration. 2024-04-19T11:39:39,845 !! 2024-04-19T11:39:39,846 ******************************************************************************** 2024-04-19T11:39:39,846 ############################ 2024-04-19T11:39:39,846 # Package would be ignored # 2024-04-19T11:39:39,847 ############################ 2024-04-19T11:39:39,847 Python recognizes 'moleculekit.bondguesser_utils' as an importable package[^1], 2024-04-19T11:39:39,848 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:39,849 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:39,849 package, please make sure that 'moleculekit.bondguesser_utils' is explicitly added 2024-04-19T11:39:39,850 to the `packages` configuration field. 2024-04-19T11:39:39,851 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:39,852 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:39,852 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:39,853 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:39,854 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:39,855 If you don't want 'moleculekit.bondguesser_utils' to be distributed and are 2024-04-19T11:39:39,856 already explicitly excluding 'moleculekit.bondguesser_utils' via 2024-04-19T11:39:39,856 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:39,857 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:39,857 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:39,858 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:39,859 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:39,861 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:39,861 even if it does not contain any `.py` files. 2024-04-19T11:39:39,862 On the other hand, currently there is no concept of package data 2024-04-19T11:39:39,862 directory, all directories are treated like packages. 2024-04-19T11:39:39,863 ******************************************************************************** 2024-04-19T11:39:39,864 !! 2024-04-19T11:39:39,864 check.warn(importable) 2024-04-19T11:39:39,865 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.cython_utils' is absent from the `packages` configuration. 2024-04-19T11:39:39,865 !! 2024-04-19T11:39:39,866 ******************************************************************************** 2024-04-19T11:39:39,867 ############################ 2024-04-19T11:39:39,867 # Package would be ignored # 2024-04-19T11:39:39,867 ############################ 2024-04-19T11:39:39,868 Python recognizes 'moleculekit.cython_utils' as an importable package[^1], 2024-04-19T11:39:39,868 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:39,869 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:39,869 package, please make sure that 'moleculekit.cython_utils' is explicitly added 2024-04-19T11:39:39,870 to the `packages` configuration field. 2024-04-19T11:39:39,870 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:39,871 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:39,871 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:39,872 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:39,873 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:39,873 If you don't want 'moleculekit.cython_utils' to be distributed and are 2024-04-19T11:39:39,874 already explicitly excluding 'moleculekit.cython_utils' via 2024-04-19T11:39:39,874 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:39,875 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:39,875 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:39,876 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:39,878 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:39,879 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:39,880 even if it does not contain any `.py` files. 2024-04-19T11:39:39,880 On the other hand, currently there is no concept of package data 2024-04-19T11:39:39,881 directory, all directories are treated like packages. 2024-04-19T11:39:39,882 ******************************************************************************** 2024-04-19T11:39:39,883 !! 2024-04-19T11:39:39,883 check.warn(importable) 2024-04-19T11:39:39,884 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.distance_utils' is absent from the `packages` configuration. 2024-04-19T11:39:39,885 !! 2024-04-19T11:39:39,885 ******************************************************************************** 2024-04-19T11:39:39,886 ############################ 2024-04-19T11:39:39,886 # Package would be ignored # 2024-04-19T11:39:39,887 ############################ 2024-04-19T11:39:39,887 Python recognizes 'moleculekit.distance_utils' as an importable package[^1], 2024-04-19T11:39:39,888 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:39,889 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:39,889 package, please make sure that 'moleculekit.distance_utils' is explicitly added 2024-04-19T11:39:39,890 to the `packages` configuration field. 2024-04-19T11:39:39,891 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:39,892 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:39,892 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:39,893 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:39,894 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:39,895 If you don't want 'moleculekit.distance_utils' to be distributed and are 2024-04-19T11:39:39,895 already explicitly excluding 'moleculekit.distance_utils' via 2024-04-19T11:39:39,896 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:39,896 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:39,896 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:39,897 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:39,898 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:39,899 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:39,899 even if it does not contain any `.py` files. 2024-04-19T11:39:39,900 On the other hand, currently there is no concept of package data 2024-04-19T11:39:39,900 directory, all directories are treated like packages. 2024-04-19T11:39:39,900 ******************************************************************************** 2024-04-19T11:39:39,901 !! 2024-04-19T11:39:39,902 check.warn(importable) 2024-04-19T11:39:39,902 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos' is absent from the `packages` configuration. 2024-04-19T11:39:39,902 !! 2024-04-19T11:39:39,903 ******************************************************************************** 2024-04-19T11:39:39,904 ############################ 2024-04-19T11:39:39,904 # Package would be ignored # 2024-04-19T11:39:39,905 ############################ 2024-04-19T11:39:39,906 Python recognizes 'moleculekit.fileformats.binpos' as an importable package[^1], 2024-04-19T11:39:39,906 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:39,907 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:39,908 package, please make sure that 'moleculekit.fileformats.binpos' is explicitly added 2024-04-19T11:39:39,908 to the `packages` configuration field. 2024-04-19T11:39:39,910 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:39,910 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:39,911 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:39,912 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:39,912 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:39,913 If you don't want 'moleculekit.fileformats.binpos' to be distributed and are 2024-04-19T11:39:39,914 already explicitly excluding 'moleculekit.fileformats.binpos' via 2024-04-19T11:39:39,914 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:39,915 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:39,915 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:39,916 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:39,917 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:39,919 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:39,920 even if it does not contain any `.py` files. 2024-04-19T11:39:39,920 On the other hand, currently there is no concept of package data 2024-04-19T11:39:39,921 directory, all directories are treated like packages. 2024-04-19T11:39:39,922 ******************************************************************************** 2024-04-19T11:39:39,922 !! 2024-04-19T11:39:39,923 check.warn(importable) 2024-04-19T11:39:39,923 /tmp/pip-build-env-ot2ws_un/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. 2024-04-19T11:39:39,923 !! 2024-04-19T11:39:39,924 ******************************************************************************** 2024-04-19T11:39:39,924 ############################ 2024-04-19T11:39:39,925 # Package would be ignored # 2024-04-19T11:39:39,925 ############################ 2024-04-19T11:39:39,925 Python recognizes 'moleculekit.fileformats.binpos.include' as an importable package[^1], 2024-04-19T11:39:39,926 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:39,927 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:39,927 package, please make sure that 'moleculekit.fileformats.binpos.include' is explicitly added 2024-04-19T11:39:39,927 to the `packages` configuration field. 2024-04-19T11:39:39,928 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:39,929 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:39,929 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:39,930 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:39,931 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:39,932 If you don't want 'moleculekit.fileformats.binpos.include' to be distributed and are 2024-04-19T11:39:39,933 already explicitly excluding 'moleculekit.fileformats.binpos.include' via 2024-04-19T11:39:39,933 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:39,934 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:39,934 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:39,935 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:39,936 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:39,938 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:39,938 even if it does not contain any `.py` files. 2024-04-19T11:39:39,939 On the other hand, currently there is no concept of package data 2024-04-19T11:39:39,939 directory, all directories are treated like packages. 2024-04-19T11:39:39,940 ******************************************************************************** 2024-04-19T11:39:39,941 !! 2024-04-19T11:39:39,941 check.warn(importable) 2024-04-19T11:39:39,941 /tmp/pip-build-env-ot2ws_un/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. 2024-04-19T11:39:39,942 !! 2024-04-19T11:39:39,943 ******************************************************************************** 2024-04-19T11:39:39,943 ############################ 2024-04-19T11:39:39,944 # Package would be ignored # 2024-04-19T11:39:39,944 ############################ 2024-04-19T11:39:39,945 Python recognizes 'moleculekit.fileformats.binpos.src' as an importable package[^1], 2024-04-19T11:39:39,945 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:39,947 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:39,947 package, please make sure that 'moleculekit.fileformats.binpos.src' is explicitly added 2024-04-19T11:39:39,947 to the `packages` configuration field. 2024-04-19T11:39:39,948 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:39,948 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:39,949 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:39,949 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:39,950 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:39,951 If you don't want 'moleculekit.fileformats.binpos.src' to be distributed and are 2024-04-19T11:39:39,951 already explicitly excluding 'moleculekit.fileformats.binpos.src' via 2024-04-19T11:39:39,951 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:39,952 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:39,952 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:39,953 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:39,954 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:39,955 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:39,955 even if it does not contain any `.py` files. 2024-04-19T11:39:39,955 On the other hand, currently there is no concept of package data 2024-04-19T11:39:39,956 directory, all directories are treated like packages. 2024-04-19T11:39:39,956 ******************************************************************************** 2024-04-19T11:39:39,957 !! 2024-04-19T11:39:39,958 check.warn(importable) 2024-04-19T11:39:39,958 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd' is absent from the `packages` configuration. 2024-04-19T11:39:39,959 !! 2024-04-19T11:39:39,960 ******************************************************************************** 2024-04-19T11:39:39,960 ############################ 2024-04-19T11:39:39,961 # Package would be ignored # 2024-04-19T11:39:39,961 ############################ 2024-04-19T11:39:39,962 Python recognizes 'moleculekit.fileformats.dcd' as an importable package[^1], 2024-04-19T11:39:39,962 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:39,963 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:39,964 package, please make sure that 'moleculekit.fileformats.dcd' is explicitly added 2024-04-19T11:39:39,964 to the `packages` configuration field. 2024-04-19T11:39:39,965 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:39,966 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:39,966 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:39,967 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:39,968 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:39,969 If you don't want 'moleculekit.fileformats.dcd' to be distributed and are 2024-04-19T11:39:39,970 already explicitly excluding 'moleculekit.fileformats.dcd' via 2024-04-19T11:39:39,970 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:39,971 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:39,972 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:39,972 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:39,973 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:39,974 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:39,974 even if it does not contain any `.py` files. 2024-04-19T11:39:39,975 On the other hand, currently there is no concept of package data 2024-04-19T11:39:39,975 directory, all directories are treated like packages. 2024-04-19T11:39:39,975 ******************************************************************************** 2024-04-19T11:39:39,976 !! 2024-04-19T11:39:39,976 check.warn(importable) 2024-04-19T11:39:39,977 /tmp/pip-build-env-ot2ws_un/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. 2024-04-19T11:39:39,977 !! 2024-04-19T11:39:39,978 ******************************************************************************** 2024-04-19T11:39:39,978 ############################ 2024-04-19T11:39:39,979 # Package would be ignored # 2024-04-19T11:39:39,979 ############################ 2024-04-19T11:39:39,979 Python recognizes 'moleculekit.fileformats.dcd.include' as an importable package[^1], 2024-04-19T11:39:39,980 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:39,981 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:39,982 package, please make sure that 'moleculekit.fileformats.dcd.include' is explicitly added 2024-04-19T11:39:39,982 to the `packages` configuration field. 2024-04-19T11:39:39,983 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:39,983 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:39,984 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:39,985 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:39,986 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:39,987 If you don't want 'moleculekit.fileformats.dcd.include' to be distributed and are 2024-04-19T11:39:39,988 already explicitly excluding 'moleculekit.fileformats.dcd.include' via 2024-04-19T11:39:39,988 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:39,989 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:39,990 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:39,991 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:39,992 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:39,993 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:39,994 even if it does not contain any `.py` files. 2024-04-19T11:39:39,994 On the other hand, currently there is no concept of package data 2024-04-19T11:39:39,995 directory, all directories are treated like packages. 2024-04-19T11:39:39,995 ******************************************************************************** 2024-04-19T11:39:39,996 !! 2024-04-19T11:39:39,997 check.warn(importable) 2024-04-19T11:39:39,998 /tmp/pip-build-env-ot2ws_un/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. 2024-04-19T11:39:39,998 !! 2024-04-19T11:39:39,999 ******************************************************************************** 2024-04-19T11:39:40,000 ############################ 2024-04-19T11:39:40,000 # Package would be ignored # 2024-04-19T11:39:40,001 ############################ 2024-04-19T11:39:40,001 Python recognizes 'moleculekit.fileformats.dcd.src' as an importable package[^1], 2024-04-19T11:39:40,001 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,002 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,003 package, please make sure that 'moleculekit.fileformats.dcd.src' is explicitly added 2024-04-19T11:39:40,003 to the `packages` configuration field. 2024-04-19T11:39:40,004 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,005 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,005 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,006 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,007 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,008 If you don't want 'moleculekit.fileformats.dcd.src' to be distributed and are 2024-04-19T11:39:40,008 already explicitly excluding 'moleculekit.fileformats.dcd.src' via 2024-04-19T11:39:40,009 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,009 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,010 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,011 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,012 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,013 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,014 even if it does not contain any `.py` files. 2024-04-19T11:39:40,014 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,015 directory, all directories are treated like packages. 2024-04-19T11:39:40,015 ******************************************************************************** 2024-04-19T11:39:40,017 !! 2024-04-19T11:39:40,017 check.warn(importable) 2024-04-19T11:39:40,018 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc' is absent from the `packages` configuration. 2024-04-19T11:39:40,019 !! 2024-04-19T11:39:40,021 ******************************************************************************** 2024-04-19T11:39:40,021 ############################ 2024-04-19T11:39:40,022 # Package would be ignored # 2024-04-19T11:39:40,023 ############################ 2024-04-19T11:39:40,023 Python recognizes 'moleculekit.fileformats.xtc' as an importable package[^1], 2024-04-19T11:39:40,024 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,025 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,026 package, please make sure that 'moleculekit.fileformats.xtc' is explicitly added 2024-04-19T11:39:40,026 to the `packages` configuration field. 2024-04-19T11:39:40,027 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,028 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,029 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,030 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,031 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,032 If you don't want 'moleculekit.fileformats.xtc' to be distributed and are 2024-04-19T11:39:40,033 already explicitly excluding 'moleculekit.fileformats.xtc' via 2024-04-19T11:39:40,033 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,034 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,034 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,035 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,036 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,038 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,038 even if it does not contain any `.py` files. 2024-04-19T11:39:40,039 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,045 directory, all directories are treated like packages. 2024-04-19T11:39:40,046 ******************************************************************************** 2024-04-19T11:39:40,047 !! 2024-04-19T11:39:40,047 check.warn(importable) 2024-04-19T11:39:40,047 /tmp/pip-build-env-ot2ws_un/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. 2024-04-19T11:39:40,048 !! 2024-04-19T11:39:40,049 ******************************************************************************** 2024-04-19T11:39:40,049 ############################ 2024-04-19T11:39:40,050 # Package would be ignored # 2024-04-19T11:39:40,050 ############################ 2024-04-19T11:39:40,051 Python recognizes 'moleculekit.fileformats.xtc.include' as an importable package[^1], 2024-04-19T11:39:40,051 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,052 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,053 package, please make sure that 'moleculekit.fileformats.xtc.include' is explicitly added 2024-04-19T11:39:40,054 to the `packages` configuration field. 2024-04-19T11:39:40,055 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,055 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,056 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,057 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,058 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,059 If you don't want 'moleculekit.fileformats.xtc.include' to be distributed and are 2024-04-19T11:39:40,060 already explicitly excluding 'moleculekit.fileformats.xtc.include' via 2024-04-19T11:39:40,061 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,061 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,063 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,065 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,067 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,070 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,074 even if it does not contain any `.py` files. 2024-04-19T11:39:40,075 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,076 directory, all directories are treated like packages. 2024-04-19T11:39:40,076 ******************************************************************************** 2024-04-19T11:39:40,077 !! 2024-04-19T11:39:40,077 check.warn(importable) 2024-04-19T11:39:40,078 /tmp/pip-build-env-ot2ws_un/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. 2024-04-19T11:39:40,078 !! 2024-04-19T11:39:40,079 ******************************************************************************** 2024-04-19T11:39:40,079 ############################ 2024-04-19T11:39:40,080 # Package would be ignored # 2024-04-19T11:39:40,088 ############################ 2024-04-19T11:39:40,090 Python recognizes 'moleculekit.fileformats.xtc.src' as an importable package[^1], 2024-04-19T11:39:40,094 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,098 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,099 package, please make sure that 'moleculekit.fileformats.xtc.src' is explicitly added 2024-04-19T11:39:40,099 to the `packages` configuration field. 2024-04-19T11:39:40,100 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,101 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,101 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,102 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,104 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,108 If you don't want 'moleculekit.fileformats.xtc.src' to be distributed and are 2024-04-19T11:39:40,109 already explicitly excluding 'moleculekit.fileformats.xtc.src' via 2024-04-19T11:39:40,110 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,111 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,115 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,124 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,126 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,127 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,128 even if it does not contain any `.py` files. 2024-04-19T11:39:40,129 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,129 directory, all directories are treated like packages. 2024-04-19T11:39:40,130 ******************************************************************************** 2024-04-19T11:39:40,131 !! 2024-04-19T11:39:40,132 check.warn(importable) 2024-04-19T11:39:40,132 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.cationpi' is absent from the `packages` configuration. 2024-04-19T11:39:40,133 !! 2024-04-19T11:39:40,138 ******************************************************************************** 2024-04-19T11:39:40,139 ############################ 2024-04-19T11:39:40,139 # Package would be ignored # 2024-04-19T11:39:40,140 ############################ 2024-04-19T11:39:40,141 Python recognizes 'moleculekit.interactions.cationpi' as an importable package[^1], 2024-04-19T11:39:40,141 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,143 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,144 package, please make sure that 'moleculekit.interactions.cationpi' is explicitly added 2024-04-19T11:39:40,144 to the `packages` configuration field. 2024-04-19T11:39:40,151 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,153 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,155 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,156 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,157 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,158 If you don't want 'moleculekit.interactions.cationpi' to be distributed and are 2024-04-19T11:39:40,158 already explicitly excluding 'moleculekit.interactions.cationpi' via 2024-04-19T11:39:40,159 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,159 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,159 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,160 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,161 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,163 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,163 even if it does not contain any `.py` files. 2024-04-19T11:39:40,163 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,164 directory, all directories are treated like packages. 2024-04-19T11:39:40,164 ******************************************************************************** 2024-04-19T11:39:40,165 !! 2024-04-19T11:39:40,166 check.warn(importable) 2024-04-19T11:39:40,167 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.hbonds' is absent from the `packages` configuration. 2024-04-19T11:39:40,167 !! 2024-04-19T11:39:40,169 ******************************************************************************** 2024-04-19T11:39:40,169 ############################ 2024-04-19T11:39:40,170 # Package would be ignored # 2024-04-19T11:39:40,171 ############################ 2024-04-19T11:39:40,171 Python recognizes 'moleculekit.interactions.hbonds' as an importable package[^1], 2024-04-19T11:39:40,172 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,173 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,174 package, please make sure that 'moleculekit.interactions.hbonds' is explicitly added 2024-04-19T11:39:40,174 to the `packages` configuration field. 2024-04-19T11:39:40,175 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,176 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,176 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,178 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,179 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,180 If you don't want 'moleculekit.interactions.hbonds' to be distributed and are 2024-04-19T11:39:40,181 already explicitly excluding 'moleculekit.interactions.hbonds' via 2024-04-19T11:39:40,181 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,182 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,183 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,184 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,185 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,186 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,186 even if it does not contain any `.py` files. 2024-04-19T11:39:40,187 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,187 directory, all directories are treated like packages. 2024-04-19T11:39:40,188 ******************************************************************************** 2024-04-19T11:39:40,188 !! 2024-04-19T11:39:40,189 check.warn(importable) 2024-04-19T11:39:40,189 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.pipi' is absent from the `packages` configuration. 2024-04-19T11:39:40,190 !! 2024-04-19T11:39:40,191 ******************************************************************************** 2024-04-19T11:39:40,191 ############################ 2024-04-19T11:39:40,192 # Package would be ignored # 2024-04-19T11:39:40,192 ############################ 2024-04-19T11:39:40,192 Python recognizes 'moleculekit.interactions.pipi' as an importable package[^1], 2024-04-19T11:39:40,193 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,194 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,195 package, please make sure that 'moleculekit.interactions.pipi' is explicitly added 2024-04-19T11:39:40,195 to the `packages` configuration field. 2024-04-19T11:39:40,197 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,198 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,198 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,200 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,201 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,202 If you don't want 'moleculekit.interactions.pipi' to be distributed and are 2024-04-19T11:39:40,203 already explicitly excluding 'moleculekit.interactions.pipi' via 2024-04-19T11:39:40,203 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,204 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,204 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,205 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,206 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,208 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,209 even if it does not contain any `.py` files. 2024-04-19T11:39:40,209 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,210 directory, all directories are treated like packages. 2024-04-19T11:39:40,210 ******************************************************************************** 2024-04-19T11:39:40,212 !! 2024-04-19T11:39:40,212 check.warn(importable) 2024-04-19T11:39:40,213 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.sigmahole' is absent from the `packages` configuration. 2024-04-19T11:39:40,214 !! 2024-04-19T11:39:40,215 ******************************************************************************** 2024-04-19T11:39:40,215 ############################ 2024-04-19T11:39:40,216 # Package would be ignored # 2024-04-19T11:39:40,216 ############################ 2024-04-19T11:39:40,217 Python recognizes 'moleculekit.interactions.sigmahole' as an importable package[^1], 2024-04-19T11:39:40,217 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,218 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,218 package, please make sure that 'moleculekit.interactions.sigmahole' is explicitly added 2024-04-19T11:39:40,219 to the `packages` configuration field. 2024-04-19T11:39:40,220 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,220 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,221 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,222 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,223 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,225 If you don't want 'moleculekit.interactions.sigmahole' to be distributed and are 2024-04-19T11:39:40,226 already explicitly excluding 'moleculekit.interactions.sigmahole' via 2024-04-19T11:39:40,257 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,259 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,264 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,309 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,363 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,369 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,369 even if it does not contain any `.py` files. 2024-04-19T11:39:40,370 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,370 directory, all directories are treated like packages. 2024-04-19T11:39:40,371 ******************************************************************************** 2024-04-19T11:39:40,372 !! 2024-04-19T11:39:40,372 check.warn(importable) 2024-04-19T11:39:40,373 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.occupancy_utils' is absent from the `packages` configuration. 2024-04-19T11:39:40,374 !! 2024-04-19T11:39:40,375 ******************************************************************************** 2024-04-19T11:39:40,375 ############################ 2024-04-19T11:39:40,376 # Package would be ignored # 2024-04-19T11:39:40,376 ############################ 2024-04-19T11:39:40,377 Python recognizes 'moleculekit.occupancy_utils' as an importable package[^1], 2024-04-19T11:39:40,378 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,379 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,379 package, please make sure that 'moleculekit.occupancy_utils' is explicitly added 2024-04-19T11:39:40,380 to the `packages` configuration field. 2024-04-19T11:39:40,381 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,381 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,382 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,383 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,384 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,385 If you don't want 'moleculekit.occupancy_utils' to be distributed and are 2024-04-19T11:39:40,385 already explicitly excluding 'moleculekit.occupancy_utils' via 2024-04-19T11:39:40,386 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,386 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,386 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,387 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,388 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,389 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,390 even if it does not contain any `.py` files. 2024-04-19T11:39:40,390 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,391 directory, all directories are treated like packages. 2024-04-19T11:39:40,391 ******************************************************************************** 2024-04-19T11:39:40,392 !! 2024-04-19T11:39:40,393 check.warn(importable) 2024-04-19T11:39:40,393 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share' is absent from the `packages` configuration. 2024-04-19T11:39:40,393 !! 2024-04-19T11:39:40,394 ******************************************************************************** 2024-04-19T11:39:40,395 ############################ 2024-04-19T11:39:40,396 # Package would be ignored # 2024-04-19T11:39:40,396 ############################ 2024-04-19T11:39:40,397 Python recognizes 'moleculekit.share' as an importable package[^1], 2024-04-19T11:39:40,397 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,398 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,399 package, please make sure that 'moleculekit.share' is explicitly added 2024-04-19T11:39:40,399 to the `packages` configuration field. 2024-04-19T11:39:40,400 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,401 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,401 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,402 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,403 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,404 If you don't want 'moleculekit.share' to be distributed and are 2024-04-19T11:39:40,405 already explicitly excluding 'moleculekit.share' via 2024-04-19T11:39:40,405 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,406 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,406 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,407 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,408 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,410 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,411 even if it does not contain any `.py` files. 2024-04-19T11:39:40,412 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,413 directory, all directories are treated like packages. 2024-04-19T11:39:40,413 ******************************************************************************** 2024-04-19T11:39:40,414 !! 2024-04-19T11:39:40,415 check.warn(importable) 2024-04-19T11:39:40,415 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share.atomselect' is absent from the `packages` configuration. 2024-04-19T11:39:40,415 !! 2024-04-19T11:39:40,417 ******************************************************************************** 2024-04-19T11:39:40,417 ############################ 2024-04-19T11:39:40,417 # Package would be ignored # 2024-04-19T11:39:40,418 ############################ 2024-04-19T11:39:40,418 Python recognizes 'moleculekit.share.atomselect' as an importable package[^1], 2024-04-19T11:39:40,419 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,420 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,420 package, please make sure that 'moleculekit.share.atomselect' is explicitly added 2024-04-19T11:39:40,421 to the `packages` configuration field. 2024-04-19T11:39:40,422 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,422 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,423 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,424 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,425 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,426 If you don't want 'moleculekit.share.atomselect' to be distributed and are 2024-04-19T11:39:40,426 already explicitly excluding 'moleculekit.share.atomselect' via 2024-04-19T11:39:40,427 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,427 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,428 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,429 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,430 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,432 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,433 even if it does not contain any `.py` files. 2024-04-19T11:39:40,433 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,434 directory, all directories are treated like packages. 2024-04-19T11:39:40,435 ******************************************************************************** 2024-04-19T11:39:40,436 !! 2024-04-19T11:39:40,436 check.warn(importable) 2024-04-19T11:39:40,437 /tmp/pip-build-env-ot2ws_un/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. 2024-04-19T11:39:40,438 !! 2024-04-19T11:39:40,439 ******************************************************************************** 2024-04-19T11:39:40,440 ############################ 2024-04-19T11:39:40,440 # Package would be ignored # 2024-04-19T11:39:40,441 ############################ 2024-04-19T11:39:40,442 Python recognizes 'moleculekit.share.pdb2pqr.residues' as an importable package[^1], 2024-04-19T11:39:40,442 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,443 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,444 package, please make sure that 'moleculekit.share.pdb2pqr.residues' is explicitly added 2024-04-19T11:39:40,445 to the `packages` configuration field. 2024-04-19T11:39:40,446 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,447 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,447 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,448 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,449 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,450 If you don't want 'moleculekit.share.pdb2pqr.residues' to be distributed and are 2024-04-19T11:39:40,450 already explicitly excluding 'moleculekit.share.pdb2pqr.residues' via 2024-04-19T11:39:40,451 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,451 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,452 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,453 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,454 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,455 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,456 even if it does not contain any `.py` files. 2024-04-19T11:39:40,456 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,457 directory, all directories are treated like packages. 2024-04-19T11:39:40,457 ******************************************************************************** 2024-04-19T11:39:40,458 !! 2024-04-19T11:39:40,459 check.warn(importable) 2024-04-19T11:39:40,459 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign' is absent from the `packages` configuration. 2024-04-19T11:39:40,460 !! 2024-04-19T11:39:40,461 ******************************************************************************** 2024-04-19T11:39:40,461 ############################ 2024-04-19T11:39:40,462 # Package would be ignored # 2024-04-19T11:39:40,462 ############################ 2024-04-19T11:39:40,463 Python recognizes 'moleculekit.tmalign' as an importable package[^1], 2024-04-19T11:39:40,463 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,464 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,465 package, please make sure that 'moleculekit.tmalign' is explicitly added 2024-04-19T11:39:40,465 to the `packages` configuration field. 2024-04-19T11:39:40,466 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,467 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,468 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,469 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,470 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,471 If you don't want 'moleculekit.tmalign' to be distributed and are 2024-04-19T11:39:40,472 already explicitly excluding 'moleculekit.tmalign' via 2024-04-19T11:39:40,473 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,473 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,474 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,475 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,476 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,478 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,478 even if it does not contain any `.py` files. 2024-04-19T11:39:40,479 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,479 directory, all directories are treated like packages. 2024-04-19T11:39:40,480 ******************************************************************************** 2024-04-19T11:39:40,481 !! 2024-04-19T11:39:40,481 check.warn(importable) 2024-04-19T11:39:40,482 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.include' is absent from the `packages` configuration. 2024-04-19T11:39:40,482 !! 2024-04-19T11:39:40,483 ******************************************************************************** 2024-04-19T11:39:40,484 ############################ 2024-04-19T11:39:40,484 # Package would be ignored # 2024-04-19T11:39:40,485 ############################ 2024-04-19T11:39:40,486 Python recognizes 'moleculekit.tmalign.include' as an importable package[^1], 2024-04-19T11:39:40,486 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,487 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,488 package, please make sure that 'moleculekit.tmalign.include' is explicitly added 2024-04-19T11:39:40,488 to the `packages` configuration field. 2024-04-19T11:39:40,489 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,490 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,490 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,491 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,493 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,494 If you don't want 'moleculekit.tmalign.include' to be distributed and are 2024-04-19T11:39:40,494 already explicitly excluding 'moleculekit.tmalign.include' via 2024-04-19T11:39:40,495 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,495 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,496 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,497 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,498 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,500 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,501 even if it does not contain any `.py` files. 2024-04-19T11:39:40,501 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,502 directory, all directories are treated like packages. 2024-04-19T11:39:40,502 ******************************************************************************** 2024-04-19T11:39:40,504 !! 2024-04-19T11:39:40,504 check.warn(importable) 2024-04-19T11:39:40,505 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.src' is absent from the `packages` configuration. 2024-04-19T11:39:40,505 !! 2024-04-19T11:39:40,506 ******************************************************************************** 2024-04-19T11:39:40,507 ############################ 2024-04-19T11:39:40,508 # Package would be ignored # 2024-04-19T11:39:40,508 ############################ 2024-04-19T11:39:40,509 Python recognizes 'moleculekit.tmalign.src' as an importable package[^1], 2024-04-19T11:39:40,509 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,510 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,511 package, please make sure that 'moleculekit.tmalign.src' is explicitly added 2024-04-19T11:39:40,511 to the `packages` configuration field. 2024-04-19T11:39:40,512 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,512 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,513 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,514 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,515 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,515 If you don't want 'moleculekit.tmalign.src' to be distributed and are 2024-04-19T11:39:40,516 already explicitly excluding 'moleculekit.tmalign.src' via 2024-04-19T11:39:40,517 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,517 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,517 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,518 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,519 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,521 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,521 even if it does not contain any `.py` files. 2024-04-19T11:39:40,522 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,523 directory, all directories are treated like packages. 2024-04-19T11:39:40,523 ******************************************************************************** 2024-04-19T11:39:40,524 !! 2024-04-19T11:39:40,525 check.warn(importable) 2024-04-19T11:39:40,525 /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.wrapping' is absent from the `packages` configuration. 2024-04-19T11:39:40,526 !! 2024-04-19T11:39:40,527 ******************************************************************************** 2024-04-19T11:39:40,528 ############################ 2024-04-19T11:39:40,528 # Package would be ignored # 2024-04-19T11:39:40,529 ############################ 2024-04-19T11:39:40,529 Python recognizes 'moleculekit.wrapping' as an importable package[^1], 2024-04-19T11:39:40,530 but it is absent from setuptools' `packages` configuration. 2024-04-19T11:39:40,531 This leads to an ambiguous overall configuration. If you want to distribute this 2024-04-19T11:39:40,532 package, please make sure that 'moleculekit.wrapping' is explicitly added 2024-04-19T11:39:40,532 to the `packages` configuration field. 2024-04-19T11:39:40,533 Alternatively, you can also rely on setuptools' discovery methods 2024-04-19T11:39:40,534 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-04-19T11:39:40,534 instead of `find_packages(...)`/`find:`). 2024-04-19T11:39:40,536 You can read more about "package discovery" on setuptools documentation page: 2024-04-19T11:39:40,537 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-04-19T11:39:40,539 If you don't want 'moleculekit.wrapping' to be distributed and are 2024-04-19T11:39:40,539 already explicitly excluding 'moleculekit.wrapping' via 2024-04-19T11:39:40,540 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-04-19T11:39:40,540 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-04-19T11:39:40,540 combination with a more fine grained `package-data` configuration. 2024-04-19T11:39:40,541 You can read more about "package data files" on setuptools documentation page: 2024-04-19T11:39:40,542 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-04-19T11:39:40,544 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-04-19T11:39:40,544 even if it does not contain any `.py` files. 2024-04-19T11:39:40,544 On the other hand, currently there is no concept of package data 2024-04-19T11:39:40,545 directory, all directories are treated like packages. 2024-04-19T11:39:40,545 ******************************************************************************** 2024-04-19T11:39:40,546 !! 2024-04-19T11:39:40,547 check.warn(importable) 2024-04-19T11:39:40,547 copying moleculekit/logging.ini -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:40,548 copying moleculekit/vmd_wrapper -> build/lib.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:40,548 creating build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-04-19T11:39:40,549 copying moleculekit/atomselect_utils/atomselect_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-04-19T11:39:40,550 copying moleculekit/atomselect_utils/atomselect_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-04-19T11:39:40,550 creating build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-04-19T11:39:40,551 copying moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-04-19T11:39:40,551 copying moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-04-19T11:39:40,552 creating build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-04-19T11:39:40,552 copying moleculekit/cython_utils/cython_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-04-19T11:39:40,553 copying moleculekit/cython_utils/cython_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-04-19T11:39:40,553 creating build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-04-19T11:39:40,554 copying moleculekit/distance_utils/distance_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-04-19T11:39:40,554 copying moleculekit/distance_utils/distance_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-04-19T11:39:40,555 creating build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-04-19T11:39:40,556 copying moleculekit/occupancy_utils/occupancy_utils.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-04-19T11:39:40,556 copying moleculekit/occupancy_utils/occupancy_utils.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-04-19T11:39:40,557 creating build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-04-19T11:39:40,557 copying moleculekit/share/ALA.cif -> build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-04-19T11:39:40,558 copying moleculekit/share/backbone.cif -> build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-04-19T11:39:40,558 copying moleculekit/share/opm_sequences.json -> build/lib.linux-armv7l-cpython-311/moleculekit/share 2024-04-19T11:39:40,559 creating build/lib.linux-armv7l-cpython-311/moleculekit/share/atomselect 2024-04-19T11:39:40,560 copying moleculekit/share/atomselect/atomselect.json -> build/lib.linux-armv7l-cpython-311/moleculekit/share/atomselect 2024-04-19T11:39:40,560 creating build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr 2024-04-19T11:39:40,561 creating build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,561 copying moleculekit/share/pdb2pqr/residues/.gitkeep -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,562 copying moleculekit/share/pdb2pqr/residues/004.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,562 copying moleculekit/share/pdb2pqr/residues/004.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,563 copying moleculekit/share/pdb2pqr/residues/03Y.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,563 copying moleculekit/share/pdb2pqr/residues/03Y.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,564 copying moleculekit/share/pdb2pqr/residues/0A1.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,564 copying moleculekit/share/pdb2pqr/residues/0A1.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,565 copying moleculekit/share/pdb2pqr/residues/0AF.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,565 copying moleculekit/share/pdb2pqr/residues/0AF.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,566 copying moleculekit/share/pdb2pqr/residues/0BN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,566 copying moleculekit/share/pdb2pqr/residues/0BN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,567 copying moleculekit/share/pdb2pqr/residues/1MH.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,567 copying moleculekit/share/pdb2pqr/residues/1MH.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,568 copying moleculekit/share/pdb2pqr/residues/2AS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,569 copying moleculekit/share/pdb2pqr/residues/2AS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,569 copying moleculekit/share/pdb2pqr/residues/2GX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,570 copying moleculekit/share/pdb2pqr/residues/2GX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,570 copying moleculekit/share/pdb2pqr/residues/2ML.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,571 copying moleculekit/share/pdb2pqr/residues/2ML.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,572 copying moleculekit/share/pdb2pqr/residues/2MR.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,572 copying moleculekit/share/pdb2pqr/residues/2MR.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,573 copying moleculekit/share/pdb2pqr/residues/4IN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,573 copying moleculekit/share/pdb2pqr/residues/4IN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,574 copying moleculekit/share/pdb2pqr/residues/4PH.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,574 copying moleculekit/share/pdb2pqr/residues/4PH.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,575 copying moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,575 copying moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,576 copying moleculekit/share/pdb2pqr/residues/5JP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,577 copying moleculekit/share/pdb2pqr/residues/5JP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,577 copying moleculekit/share/pdb2pqr/residues/AA4.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,578 copying moleculekit/share/pdb2pqr/residues/AA4.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,578 copying moleculekit/share/pdb2pqr/residues/ABA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,579 copying moleculekit/share/pdb2pqr/residues/ABA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,579 copying moleculekit/share/pdb2pqr/residues/AHP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,580 copying moleculekit/share/pdb2pqr/residues/AHP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,580 copying moleculekit/share/pdb2pqr/residues/ALC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,581 copying moleculekit/share/pdb2pqr/residues/ALC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,581 copying moleculekit/share/pdb2pqr/residues/ALN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,582 copying moleculekit/share/pdb2pqr/residues/ALN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,582 copying moleculekit/share/pdb2pqr/residues/ALY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,583 copying moleculekit/share/pdb2pqr/residues/ALY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,583 copying moleculekit/share/pdb2pqr/residues/APD.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,584 copying moleculekit/share/pdb2pqr/residues/APD.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,584 copying moleculekit/share/pdb2pqr/residues/BB8.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,585 copying moleculekit/share/pdb2pqr/residues/BB8.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,585 copying moleculekit/share/pdb2pqr/residues/BCS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,586 copying moleculekit/share/pdb2pqr/residues/BCS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,587 copying moleculekit/share/pdb2pqr/residues/BTK.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,588 copying moleculekit/share/pdb2pqr/residues/BTK.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,588 copying moleculekit/share/pdb2pqr/residues/CCS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,589 copying moleculekit/share/pdb2pqr/residues/CCS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,589 copying moleculekit/share/pdb2pqr/residues/CGU.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,590 copying moleculekit/share/pdb2pqr/residues/CGU.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,591 copying moleculekit/share/pdb2pqr/residues/CSA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,591 copying moleculekit/share/pdb2pqr/residues/CSA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,592 copying moleculekit/share/pdb2pqr/residues/CSO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,592 copying moleculekit/share/pdb2pqr/residues/CSO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,593 copying moleculekit/share/pdb2pqr/residues/CSP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,593 copying moleculekit/share/pdb2pqr/residues/CSP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,594 copying moleculekit/share/pdb2pqr/residues/CSS.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,594 copying moleculekit/share/pdb2pqr/residues/CSS.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,595 copying moleculekit/share/pdb2pqr/residues/D4P.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,595 copying moleculekit/share/pdb2pqr/residues/D4P.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,596 copying moleculekit/share/pdb2pqr/residues/DA2.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,596 copying moleculekit/share/pdb2pqr/residues/DA2.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,597 copying moleculekit/share/pdb2pqr/residues/DAB.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,598 copying moleculekit/share/pdb2pqr/residues/DAB.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,598 copying moleculekit/share/pdb2pqr/residues/DAH.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,599 copying moleculekit/share/pdb2pqr/residues/DAH.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,599 copying moleculekit/share/pdb2pqr/residues/DPP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,600 copying moleculekit/share/pdb2pqr/residues/DPP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,600 copying moleculekit/share/pdb2pqr/residues/ESC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,601 copying moleculekit/share/pdb2pqr/residues/ESC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,602 copying moleculekit/share/pdb2pqr/residues/FGL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,602 copying moleculekit/share/pdb2pqr/residues/FGL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,603 copying moleculekit/share/pdb2pqr/residues/GHG.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,604 copying moleculekit/share/pdb2pqr/residues/GHG.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,604 copying moleculekit/share/pdb2pqr/residues/GME.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,605 copying moleculekit/share/pdb2pqr/residues/GME.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,605 copying moleculekit/share/pdb2pqr/residues/GNC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,606 copying moleculekit/share/pdb2pqr/residues/GNC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,607 copying moleculekit/share/pdb2pqr/residues/HHK.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,607 copying moleculekit/share/pdb2pqr/residues/HHK.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,608 copying moleculekit/share/pdb2pqr/residues/HLU.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,608 copying moleculekit/share/pdb2pqr/residues/HLU.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,608 copying moleculekit/share/pdb2pqr/residues/HLX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,609 copying moleculekit/share/pdb2pqr/residues/HLX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,610 copying moleculekit/share/pdb2pqr/residues/HOX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,610 copying moleculekit/share/pdb2pqr/residues/HOX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,611 copying moleculekit/share/pdb2pqr/residues/HPE.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,611 copying moleculekit/share/pdb2pqr/residues/HPE.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,612 copying moleculekit/share/pdb2pqr/residues/HQA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,612 copying moleculekit/share/pdb2pqr/residues/HQA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,613 copying moleculekit/share/pdb2pqr/residues/HTR.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,613 copying moleculekit/share/pdb2pqr/residues/HTR.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,614 copying moleculekit/share/pdb2pqr/residues/HYP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,614 copying moleculekit/share/pdb2pqr/residues/HYP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,616 copying moleculekit/share/pdb2pqr/residues/I2M.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,618 copying moleculekit/share/pdb2pqr/residues/I2M.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,620 copying moleculekit/share/pdb2pqr/residues/IGL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,622 copying moleculekit/share/pdb2pqr/residues/IGL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,624 copying moleculekit/share/pdb2pqr/residues/IIL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,626 copying moleculekit/share/pdb2pqr/residues/IIL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,628 copying moleculekit/share/pdb2pqr/residues/IML.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,630 copying moleculekit/share/pdb2pqr/residues/IML.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,632 copying moleculekit/share/pdb2pqr/residues/KYN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,634 copying moleculekit/share/pdb2pqr/residues/KYN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,636 copying moleculekit/share/pdb2pqr/residues/LME.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,638 copying moleculekit/share/pdb2pqr/residues/LME.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,640 copying moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,642 copying moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,644 copying moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,646 copying moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,648 copying moleculekit/share/pdb2pqr/residues/M3L.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,649 copying moleculekit/share/pdb2pqr/residues/M3L.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,652 copying moleculekit/share/pdb2pqr/residues/ME0.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,654 copying moleculekit/share/pdb2pqr/residues/ME0.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,656 copying moleculekit/share/pdb2pqr/residues/MEA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,657 copying moleculekit/share/pdb2pqr/residues/MEA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,659 copying moleculekit/share/pdb2pqr/residues/MEN.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,661 copying moleculekit/share/pdb2pqr/residues/MEN.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,663 copying moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,665 copying moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,667 copying moleculekit/share/pdb2pqr/residues/MLE.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,669 copying moleculekit/share/pdb2pqr/residues/MLE.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,670 copying moleculekit/share/pdb2pqr/residues/MLY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,672 copying moleculekit/share/pdb2pqr/residues/MLY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,674 copying moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,676 copying moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,678 copying moleculekit/share/pdb2pqr/residues/MME.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,680 copying moleculekit/share/pdb2pqr/residues/MME.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,682 copying moleculekit/share/pdb2pqr/residues/MMO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,684 copying moleculekit/share/pdb2pqr/residues/MMO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,686 copying moleculekit/share/pdb2pqr/residues/MVA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,688 copying moleculekit/share/pdb2pqr/residues/MVA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,690 copying moleculekit/share/pdb2pqr/residues/NAL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,692 copying moleculekit/share/pdb2pqr/residues/NAL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,694 copying moleculekit/share/pdb2pqr/residues/NCY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,696 copying moleculekit/share/pdb2pqr/residues/NCY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,698 copying moleculekit/share/pdb2pqr/residues/NLE.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,700 copying moleculekit/share/pdb2pqr/residues/NLE.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,702 copying moleculekit/share/pdb2pqr/residues/NVA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,704 copying moleculekit/share/pdb2pqr/residues/NVA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,705 copying moleculekit/share/pdb2pqr/residues/NZC.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,707 copying moleculekit/share/pdb2pqr/residues/NZC.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,709 copying moleculekit/share/pdb2pqr/residues/OCY.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,711 copying moleculekit/share/pdb2pqr/residues/OCY.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,713 copying moleculekit/share/pdb2pqr/residues/OMX.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,714 copying moleculekit/share/pdb2pqr/residues/OMX.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,716 copying moleculekit/share/pdb2pqr/residues/ONL.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,718 copying moleculekit/share/pdb2pqr/residues/ONL.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,720 copying moleculekit/share/pdb2pqr/residues/ORM.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,722 copying moleculekit/share/pdb2pqr/residues/ORM.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,724 copying moleculekit/share/pdb2pqr/residues/P1L.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,726 copying moleculekit/share/pdb2pqr/residues/P1L.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,728 copying moleculekit/share/pdb2pqr/residues/PCA.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,730 copying moleculekit/share/pdb2pqr/residues/PCA.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,732 copying moleculekit/share/pdb2pqr/residues/PRK.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,734 copying moleculekit/share/pdb2pqr/residues/PRK.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,737 copying moleculekit/share/pdb2pqr/residues/PTR.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,738 copying moleculekit/share/pdb2pqr/residues/PTR.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,741 copying moleculekit/share/pdb2pqr/residues/SEP.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,743 copying moleculekit/share/pdb2pqr/residues/SEP.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,745 copying moleculekit/share/pdb2pqr/residues/TPO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,746 copying moleculekit/share/pdb2pqr/residues/TPO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,749 copying moleculekit/share/pdb2pqr/residues/TRO.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,751 copying moleculekit/share/pdb2pqr/residues/TRO.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,752 copying moleculekit/share/pdb2pqr/residues/TY2.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,754 copying moleculekit/share/pdb2pqr/residues/TY2.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,756 copying moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,758 copying moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,760 copying moleculekit/share/pdb2pqr/residues/YCM.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,761 copying moleculekit/share/pdb2pqr/residues/YCM.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,763 copying moleculekit/share/pdb2pqr/residues/YNM.dat -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,765 copying moleculekit/share/pdb2pqr/residues/YNM.xml -> build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues 2024-04-19T11:39:40,767 creating build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-04-19T11:39:40,768 copying moleculekit/tmalign/tmalign_util.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-04-19T11:39:40,788 copying moleculekit/tmalign/tmalign_util.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-04-19T11:39:40,790 copying moleculekit/tmalign/tmalignlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign 2024-04-19T11:39:40,792 creating build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/include 2024-04-19T11:39:40,792 copying moleculekit/tmalign/include/TMAlign.h -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/include 2024-04-19T11:39:40,794 creating build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/src 2024-04-19T11:39:40,796 copying moleculekit/tmalign/src/TMAlign.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/src 2024-04-19T11:39:40,802 creating build/lib.linux-armv7l-cpython-311/moleculekit/wrapping 2024-04-19T11:39:40,804 copying moleculekit/wrapping/wrapping.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/wrapping 2024-04-19T11:39:40,825 copying moleculekit/wrapping/wrapping.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/wrapping 2024-04-19T11:39:40,828 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-04-19T11:39:40,829 copying moleculekit/fileformats/binpos/binpos.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-04-19T11:39:40,849 copying moleculekit/fileformats/binpos/binpos.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-04-19T11:39:40,851 copying moleculekit/fileformats/binpos/binposlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-04-19T11:39:40,853 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-04-19T11:39:40,854 copying moleculekit/fileformats/binpos/include/binposplugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-04-19T11:39:40,856 copying moleculekit/fileformats/binpos/include/largefiles.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-04-19T11:39:40,858 copying moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include 2024-04-19T11:39:40,861 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src 2024-04-19T11:39:40,862 copying moleculekit/fileformats/binpos/src/binposplugin.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src 2024-04-19T11:39:40,864 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-04-19T11:39:40,865 copying moleculekit/fileformats/dcd/dcd.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-04-19T11:39:40,879 copying moleculekit/fileformats/dcd/dcd.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-04-19T11:39:40,882 copying moleculekit/fileformats/dcd/dcdlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-04-19T11:39:40,883 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-04-19T11:39:40,884 copying moleculekit/fileformats/dcd/include/dcdplugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-04-19T11:39:40,886 copying moleculekit/fileformats/dcd/include/endianswap.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-04-19T11:39:40,889 copying moleculekit/fileformats/dcd/include/fastio.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-04-19T11:39:40,891 copying moleculekit/fileformats/dcd/include/largefiles.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-04-19T11:39:40,893 copying moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include 2024-04-19T11:39:40,896 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src 2024-04-19T11:39:40,897 copying moleculekit/fileformats/dcd/src/dcdplugin.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src 2024-04-19T11:39:40,900 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-04-19T11:39:40,901 copying moleculekit/fileformats/xtc/trr.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-04-19T11:39:40,922 copying moleculekit/fileformats/xtc/trr.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-04-19T11:39:40,924 copying moleculekit/fileformats/xtc/trrlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-04-19T11:39:40,926 copying moleculekit/fileformats/xtc/xdrlib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-04-19T11:39:40,928 copying moleculekit/fileformats/xtc/xtc.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-04-19T11:39:40,950 copying moleculekit/fileformats/xtc/xtc.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-04-19T11:39:40,952 copying moleculekit/fileformats/xtc/xtclib.pxd -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-04-19T11:39:40,954 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-04-19T11:39:40,955 copying moleculekit/fileformats/xtc/include/trr_header.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-04-19T11:39:40,957 copying moleculekit/fileformats/xtc/include/xdr_seek.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-04-19T11:39:40,959 copying moleculekit/fileformats/xtc/include/xdrfile.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-04-19T11:39:40,962 copying moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-04-19T11:39:40,964 copying moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-04-19T11:39:40,966 copying moleculekit/fileformats/xtc/include/xtc.h -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include 2024-04-19T11:39:40,968 creating build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-04-19T11:39:40,969 copying moleculekit/fileformats/xtc/src/xdr_seek.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-04-19T11:39:40,971 copying moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-04-19T11:39:40,974 copying moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-04-19T11:39:40,977 copying moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-04-19T11:39:40,979 copying moleculekit/fileformats/xtc/src/xtc.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-04-19T11:39:40,982 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-04-19T11:39:40,983 copying moleculekit/interactions/cationpi/cationpi.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-04-19T11:39:41,002 copying moleculekit/interactions/cationpi/cationpi.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-04-19T11:39:41,005 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-04-19T11:39:41,005 copying moleculekit/interactions/hbonds/hbonds.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-04-19T11:39:41,025 copying moleculekit/interactions/hbonds/hbonds.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-04-19T11:39:41,028 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-04-19T11:39:41,029 copying moleculekit/interactions/pipi/pipi.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-04-19T11:39:41,048 copying moleculekit/interactions/pipi/pipi.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-04-19T11:39:41,050 creating build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-04-19T11:39:41,051 copying moleculekit/interactions/sigmahole/sigmahole.cpp -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-04-19T11:39:41,073 copying moleculekit/interactions/sigmahole/sigmahole.pyx -> build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-04-19T11:39:41,084 UPDATING build/lib.linux-armv7l-cpython-311/moleculekit/_version.py 2024-04-19T11:39:41,085 set build/lib.linux-armv7l-cpython-311/moleculekit/_version.py to '1.8.31' 2024-04-19T11:39:41,085 running build_ext 2024-04-19T11:39:41,097 building 'moleculekit.interactions.hbonds' extension 2024-04-19T11:39:41,097 creating build/temp.linux-armv7l-cpython-311 2024-04-19T11:39:41,098 creating build/temp.linux-armv7l-cpython-311/moleculekit 2024-04-19T11:39:41,099 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions 2024-04-19T11:39:41,099 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/hbonds 2024-04-19T11:39:41,101 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-ot2ws_un/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 2024-04-19T11:39:41,419 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:39:41,420 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:39:41,420 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:39:41,421 from moleculekit/interactions/hbonds/hbonds.cpp:1265: 2024-04-19T11:39:41,422 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:39:41,422 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:39:41,423 | ^~~~~~~ 2024-04-19T11:40:08,859 In function ‘PyObject* __pyx_pf_11moleculekit_12interactions_6hbonds_calculate(PyObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, PyArrayObject*, float, float, bool, bool)’, 2024-04-19T11:40:08,860 inlined from ‘PyObject* __pyx_pw_11moleculekit_12interactions_6hbonds_1calculate(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/interactions/hbonds/hbonds.cpp:19989:68: 2024-04-19T11:40:08,861 moleculekit/interactions/hbonds/hbonds.cpp:21019:52: warning: ‘__pyx_v_d_idx_h’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:40:08,861 21019 | (__pyx_v_results[__pyx_v_f]).push_back(__pyx_v_d_idx_h); 2024-04-19T11:40:08,862 | ^~~~~~~~~~~~~~~ 2024-04-19T11:40:08,862 moleculekit/interactions/hbonds/hbonds.cpp: In function ‘PyObject* __pyx_pw_11moleculekit_12interactions_6hbonds_1calculate(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-04-19T11:40:08,863 moleculekit/interactions/hbonds/hbonds.cpp:20032:57: note: ‘__pyx_v_d_idx_h’ was declared here 2024-04-19T11:40:08,864 20032 | __pyx_t_11moleculekit_12interactions_6hbonds_UINT32_t __pyx_v_d_idx_h; 2024-04-19T11:40:08,865 | ^~~~~~~~~~~~~~~ 2024-04-19T11:40:11,913 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 2024-04-19T11:40:12,200 building 'moleculekit.interactions.pipi' extension 2024-04-19T11:40:12,201 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/pipi 2024-04-19T11:40:12,201 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-ot2ws_un/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 2024-04-19T11:40:12,506 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:40:12,507 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:40:12,508 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:40:12,508 from moleculekit/interactions/pipi/pipi.cpp:1265: 2024-04-19T11:40:12,509 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:40:12,509 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:40:12,510 | ^~~~~~~ 2024-04-19T11:40:45,463 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 2024-04-19T11:40:45,744 building 'moleculekit.interactions.cationpi' extension 2024-04-19T11:40:45,744 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/cationpi 2024-04-19T11:40:45,745 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-ot2ws_un/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 2024-04-19T11:40:46,058 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:40:46,059 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:40:46,059 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:40:46,060 from moleculekit/interactions/cationpi/cationpi.cpp:1265: 2024-04-19T11:40:46,060 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:40:46,061 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:40:46,061 | ^~~~~~~ 2024-04-19T11:41:18,416 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 2024-04-19T11:41:18,700 building 'moleculekit.interactions.sigmahole' extension 2024-04-19T11:41:18,701 creating build/temp.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole 2024-04-19T11:41:18,702 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-ot2ws_un/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 2024-04-19T11:41:19,012 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:41:19,013 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:41:19,013 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:41:19,014 from moleculekit/interactions/sigmahole/sigmahole.cpp:1265: 2024-04-19T11:41:19,015 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:41:19,015 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:41:19,016 | ^~~~~~~ 2024-04-19T11:41:50,917 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 2024-04-19T11:41:51,198 building 'moleculekit.wrapping' extension 2024-04-19T11:41:51,199 creating build/temp.linux-armv7l-cpython-311/moleculekit/wrapping 2024-04-19T11:41:51,200 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-ot2ws_un/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 2024-04-19T11:41:51,537 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:41:51,538 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:41:51,538 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:41:51,538 from moleculekit/wrapping/wrapping.cpp:1265: 2024-04-19T11:41:51,539 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:41:51,539 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:41:51,540 | ^~~~~~~ 2024-04-19T11:42:21,765 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 2024-04-19T11:42:21,964 building 'moleculekit.bondguesser_utils' extension 2024-04-19T11:42:21,965 creating build/temp.linux-armv7l-cpython-311/moleculekit/bondguesser_utils 2024-04-19T11:42:21,965 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-ot2ws_un/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 2024-04-19T11:42:22,269 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:42:22,270 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:42:22,271 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:42:22,272 from moleculekit/bondguesser_utils/bondguesser_utils.cpp:1265: 2024-04-19T11:42:22,272 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:42:22,273 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:42:22,273 | ^~~~~~~ 2024-04-19T11:42:24,572 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)’: 2024-04-19T11:42:24,573 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19801:33: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-04-19T11:42:24,573 19801 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-04-19T11:42:24,574 | ~~~~~~~~~~^~~~~~~~~~~ 2024-04-19T11:42:24,575 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19813:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-04-19T11:42:24,575 19813 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-04-19T11:42:24,576 | ~~~~~~~~~~^~~~~~~~~~~ 2024-04-19T11:42:24,576 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19825:37: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-04-19T11:42:24,577 19825 | for (__pyx_t_9 = 0; __pyx_t_9 < __pyx_t_8; __pyx_t_9+=1) { 2024-04-19T11:42:24,577 | ~~~~~~~~~~^~~~~~~~~~~ 2024-04-19T11:42:24,578 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19864:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,578 19864 | __pyx_t_12 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-04-19T11:42:24,579 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,579 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19903:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,580 19903 | __pyx_t_12 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-04-19T11:42:24,580 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,581 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19942:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,582 19942 | __pyx_t_12 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-04-19T11:42:24,582 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,583 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19981:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,584 19981 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-04-19T11:42:24,584 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,585 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19987:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,586 19987 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-04-19T11:42:24,587 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,587 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20028:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,588 20028 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-04-19T11:42:24,588 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,589 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20034:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,590 20034 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-04-19T11:42:24,590 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,591 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20075:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,592 20075 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-04-19T11:42:24,592 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,594 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20081:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,594 20081 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-04-19T11:42:24,594 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,595 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20122:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,595 20122 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-04-19T11:42:24,596 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,596 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20175:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,597 20175 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-04-19T11:42:24,598 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,598 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20222:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,599 20222 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-04-19T11:42:24,599 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,600 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20263:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,600 20263 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-04-19T11:42:24,601 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,602 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20269:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,602 20269 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-04-19T11:42:24,603 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,604 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20275:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,604 20275 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-04-19T11:42:24,605 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,606 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20322:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,606 20322 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-04-19T11:42:24,607 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,608 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20328:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,608 20328 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-04-19T11:42:24,609 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,610 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20369:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,610 20369 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-04-19T11:42:24,611 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,612 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20381:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,612 20381 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-04-19T11:42:24,613 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,614 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20434:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-04-19T11:42:24,614 20434 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-04-19T11:42:24,615 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,617 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)’: 2024-04-19T11:42:24,618 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21056:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-04-19T11:42:24,618 21056 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_n_boxes); 2024-04-19T11:42:24,619 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~ 2024-04-19T11:42:24,619 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21093:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-04-19T11:42:24,620 21093 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_boxidx); 2024-04-19T11:42:24,621 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-04-19T11:42:51,084 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 2024-04-19T11:42:51,351 building 'moleculekit.atomselect_utils' extension 2024-04-19T11:42:51,352 creating build/temp.linux-armv7l-cpython-311/moleculekit/atomselect_utils 2024-04-19T11:42:51,353 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-ot2ws_un/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 2024-04-19T11:42:51,659 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:42:51,660 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:42:51,660 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:42:51,661 from moleculekit/atomselect_utils/atomselect_utils.cpp:1282: 2024-04-19T11:42:51,661 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:42:51,662 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:42:51,663 | ^~~~~~~ 2024-04-19T11:42:54,173 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 >&)’: 2024-04-19T11:42:54,174 moleculekit/atomselect_utils/atomselect_utils.cpp:23255:161: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-04-19T11:42:54,175 23255 | __pyx_t_3 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_2 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_resnum); 2024-04-19T11:42:54,175 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-04-19T11:42:54,183 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 >&)’: 2024-04-19T11:42:54,183 moleculekit/atomselect_utils/atomselect_utils.cpp:23507:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-04-19T11:42:54,184 23507 | __pyx_t_6 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_5 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_i); 2024-04-19T11:42:54,184 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-04-19T11:42:54,192 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 >&)’: 2024-04-19T11:42:54,192 moleculekit/atomselect_utils/atomselect_utils.cpp:23774:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-04-19T11:42:54,193 23774 | __pyx_t_6 = ((*((__pyx_t_11moleculekit_16atomselect_utils_UINT32_t *) ( /* dim=0 */ (__pyx_v_uq_resid.data + __pyx_t_5 * __pyx_v_uq_resid.strides[0]) ))) != __pyx_v_i); 2024-04-19T11:42:54,194 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-04-19T11:43:28,444 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 2024-04-19T11:43:28,736 building 'moleculekit.distance_utils' extension 2024-04-19T11:43:28,736 creating build/temp.linux-armv7l-cpython-311/moleculekit/distance_utils 2024-04-19T11:43:28,737 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-ot2ws_un/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 2024-04-19T11:43:29,040 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:43:29,040 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:43:29,041 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:43:29,041 from moleculekit/distance_utils/distance_utils.cpp:1265: 2024-04-19T11:43:29,042 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:43:29,042 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:43:29,043 | ^~~~~~~ 2024-04-19T11:43:31,441 moleculekit/distance_utils/distance_utils.cpp: In function ‘PyObject* __pyx_pf_11moleculekit_14distance_utils_2get_collisions(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, float)’: 2024-04-19T11:43:31,442 moleculekit/distance_utils/distance_utils.cpp:21359:33: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_14distance_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-04-19T11:43:31,443 21359 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-04-19T11:43:31,443 | ~~~~~~~~~~^~~~~~~~~~~ 2024-04-19T11:43:31,444 moleculekit/distance_utils/distance_utils.cpp:21371:35: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_14distance_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-04-19T11:43:31,444 21371 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-04-19T11:43:31,445 | ~~~~~~~~~~^~~~~~~~~~~ 2024-04-19T11:44:08,648 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 2024-04-19T11:44:08,943 building 'moleculekit.occupancy_utils' extension 2024-04-19T11:44:08,944 creating build/temp.linux-armv7l-cpython-311/moleculekit/occupancy_utils 2024-04-19T11:44:08,944 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-ot2ws_un/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 2024-04-19T11:44:09,253 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:44:09,254 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:44:09,254 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:44:09,255 from moleculekit/occupancy_utils/occupancy_utils.cpp:1265: 2024-04-19T11:44:09,255 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:44:09,256 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:44:09,257 | ^~~~~~~ 2024-04-19T11:44:36,439 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 2024-04-19T11:44:36,630 building 'moleculekit.cython_utils' extension 2024-04-19T11:44:36,630 creating build/temp.linux-armv7l-cpython-311/moleculekit/cython_utils 2024-04-19T11:44:36,631 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-ot2ws_un/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 2024-04-19T11:44:36,932 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:44:36,932 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:44:36,933 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:44:36,933 from moleculekit/cython_utils/cython_utils.cpp:1265: 2024-04-19T11:44:36,934 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:44:36,934 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:44:36,935 | ^~~~~~~ 2024-04-19T11:45:06,838 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 2024-04-19T11:45:07,117 building 'moleculekit.xtc' extension 2024-04-19T11:45:07,117 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats 2024-04-19T11:45:07,118 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc 2024-04-19T11:45:07,119 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src 2024-04-19T11:45:07,120 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-ot2ws_un/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 2024-04-19T11:45:07,801 moleculekit/fileformats/xtc/src/xdrfile.cpp:66:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,801 66 | "OK", 2024-04-19T11:45:07,802 | ^~~~ 2024-04-19T11:45:07,802 moleculekit/fileformats/xtc/src/xdrfile.cpp:67:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,803 67 | "Header", 2024-04-19T11:45:07,804 | ^~~~~~~~ 2024-04-19T11:45:07,804 moleculekit/fileformats/xtc/src/xdrfile.cpp:68:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,805 68 | "String", 2024-04-19T11:45:07,806 | ^~~~~~~~ 2024-04-19T11:45:07,806 moleculekit/fileformats/xtc/src/xdrfile.cpp:69:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,807 69 | "Double", 2024-04-19T11:45:07,808 | ^~~~~~~~ 2024-04-19T11:45:07,808 moleculekit/fileformats/xtc/src/xdrfile.cpp:70:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,809 70 | "Integer", 2024-04-19T11:45:07,810 | ^~~~~~~~~ 2024-04-19T11:45:07,811 moleculekit/fileformats/xtc/src/xdrfile.cpp:71:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,811 71 | "Float", 2024-04-19T11:45:07,812 | ^~~~~~~ 2024-04-19T11:45:07,812 moleculekit/fileformats/xtc/src/xdrfile.cpp:72:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,812 72 | "Unsigned integer", 2024-04-19T11:45:07,813 | ^~~~~~~~~~~~~~~~~~ 2024-04-19T11:45:07,813 moleculekit/fileformats/xtc/src/xdrfile.cpp:73:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,814 73 | "Compressed 3D coordinate", 2024-04-19T11:45:07,814 | ^~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:45:07,815 moleculekit/fileformats/xtc/src/xdrfile.cpp:74:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,816 74 | "Closing file", 2024-04-19T11:45:07,816 | ^~~~~~~~~~~~~~ 2024-04-19T11:45:07,817 moleculekit/fileformats/xtc/src/xdrfile.cpp:75:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,817 75 | "Magic number", 2024-04-19T11:45:07,818 | ^~~~~~~~~~~~~~ 2024-04-19T11:45:07,818 moleculekit/fileformats/xtc/src/xdrfile.cpp:76:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,819 76 | "Not enough memory", 2024-04-19T11:45:07,819 | ^~~~~~~~~~~~~~~~~~~ 2024-04-19T11:45:07,820 moleculekit/fileformats/xtc/src/xdrfile.cpp:77:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,821 77 | "End of file", 2024-04-19T11:45:07,821 | ^~~~~~~~~~~~~ 2024-04-19T11:45:07,822 moleculekit/fileformats/xtc/src/xdrfile.cpp:78:9: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-04-19T11:45:07,823 78 | "File not found" 2024-04-19T11:45:07,824 | ^~~~~~~~~~~~~~~~ 2024-04-19T11:45:07,829 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofint(int)’: 2024-04-19T11:45:07,830 moleculekit/fileformats/xtc/src/xdrfile.cpp:459:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,831 459 | while (size >= num && num_of_bits < 32) 2024-04-19T11:45:07,832 | ~~~~~^~~~~~ 2024-04-19T11:45:07,832 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-04-19T11:45:07,833 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:07,834 505 | while (bytes[num_of_bytes] >= num) 2024-04-19T11:45:07,834 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-04-19T11:45:07,837 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-04-19T11:45:07,838 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,839 614 | if (num_of_bits >= num_of_bytes * 8) 2024-04-19T11:45:07,839 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-04-19T11:45:07,840 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,841 616 | for (i = 0; i < num_of_bytes; i++) 2024-04-19T11:45:07,842 | ~~^~~~~~~~~~~~~~ 2024-04-19T11:45:07,842 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,843 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-04-19T11:45:07,844 | ~~^~~~~~~~~~~~~~~~ 2024-04-19T11:45:07,844 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-04-19T11:45:07,845 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:30: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:07,845 664 | if (lastbits < num_of_bits) 2024-04-19T11:45:07,845 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-04-19T11:45:07,850 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-04-19T11:45:07,851 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:07,851 785 | if(size3>xfp->buf1size) 2024-04-19T11:45:07,852 | ~~~~~^~~~~~~~~~~~~~ 2024-04-19T11:45:07,854 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:07,855 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-04-19T11:45:07,861 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:07,861 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,862 935 | if(countmjh >= size3 ) { return -1; } 2024-04-19T11:45:07,863 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:07,863 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,864 938 | if(countmjh >= size3 ) { return -1; } 2024-04-19T11:45:07,865 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:07,865 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,866 945 | if(countmjh >= size3 ) { return -1; } 2024-04-19T11:45:07,867 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:07,867 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,868 948 | if(countmjh >= size3 ) { return -1; } 2024-04-19T11:45:07,868 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:07,869 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,870 951 | if(countmjh >= size3 ) { return -1; } 2024-04-19T11:45:07,870 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:07,871 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:24: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-04-19T11:45:07,872 756 | int smallidx, minidx, maxidx; 2024-04-19T11:45:07,872 | ^~~~~~ 2024-04-19T11:45:07,873 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:32: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-04-19T11:45:07,873 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-04-19T11:45:07,874 | ^~~~~~ 2024-04-19T11:45:07,874 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:13: warning: unused variable ‘errval’ [-Wunused-variable] 2024-04-19T11:45:07,875 763 | int errval=1; 2024-04-19T11:45:07,875 | ^~~~~~ 2024-04-19T11:45:07,876 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-04-19T11:45:07,877 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:07,877 1011 | if(size3>xfp->buf1size) 2024-04-19T11:45:07,878 | ~~~~~^~~~~~~~~~~~~~ 2024-04-19T11:45:07,880 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:41: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,880 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-04-19T11:45:07,881 | ~~~~~~~~^~~~~~~ 2024-04-19T11:45:07,882 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,883 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-04-19T11:45:07,883 | ~~~~~~~~^~~~~~~ 2024-04-19T11:45:07,884 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,885 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-04-19T11:45:07,885 | ~~~~~~~~^~~~~~~ 2024-04-19T11:45:07,887 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,888 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-04-19T11:45:07,889 | ^ 2024-04-19T11:45:07,889 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:07,890 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-04-19T11:45:07,903 | ~~~~~^~~~~~~~~~~~~~ 2024-04-19T11:45:07,904 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:07,904 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-04-19T11:45:07,915 | ~~~~~^~~~~~~~~~~~~~ 2024-04-19T11:45:07,918 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:07,918 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-04-19T11:45:07,919 | ^ 2024-04-19T11:45:07,920 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:07,920 1633 | maxidx = (LASTIDX= num && num_of_bits < 32) 2024-04-19T11:45:38,222 | ~~~~~^~~~~~ 2024-04-19T11:45:38,223 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-04-19T11:45:38,224 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:38,224 505 | while (bytes[num_of_bytes] >= num) 2024-04-19T11:45:38,225 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-04-19T11:45:38,226 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-04-19T11:45:38,226 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,227 614 | if (num_of_bits >= num_of_bytes * 8) 2024-04-19T11:45:38,228 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-04-19T11:45:38,228 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,229 616 | for (i = 0; i < num_of_bytes; i++) 2024-04-19T11:45:38,230 | ~~^~~~~~~~~~~~~~ 2024-04-19T11:45:38,231 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:31: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,232 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-04-19T11:45:38,232 | ~~^~~~~~~~~~~~~~~~ 2024-04-19T11:45:38,233 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-04-19T11:45:38,233 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:30: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:38,234 664 | if (lastbits < num_of_bits) 2024-04-19T11:45:38,235 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-04-19T11:45:38,235 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-04-19T11:45:38,236 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:38,237 785 | if(size3>xfp->buf1size) 2024-04-19T11:45:38,238 | ~~~~~^~~~~~~~~~~~~~ 2024-04-19T11:45:38,238 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:38,240 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-04-19T11:45:38,242 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:38,242 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,243 935 | if(countmjh >= size3 ) { return -1; } 2024-04-19T11:45:38,243 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:38,244 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,244 938 | if(countmjh >= size3 ) { return -1; } 2024-04-19T11:45:38,245 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:38,245 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,246 945 | if(countmjh >= size3 ) { return -1; } 2024-04-19T11:45:38,247 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:38,247 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,248 948 | if(countmjh >= size3 ) { return -1; } 2024-04-19T11:45:38,249 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:38,249 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:45: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,250 951 | if(countmjh >= size3 ) { return -1; } 2024-04-19T11:45:38,251 | ~~~~~~~~~^~~~~~~~ 2024-04-19T11:45:38,251 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:24: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-04-19T11:45:38,252 756 | int smallidx, minidx, maxidx; 2024-04-19T11:45:38,253 | ^~~~~~ 2024-04-19T11:45:38,253 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:32: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-04-19T11:45:38,254 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-04-19T11:45:38,255 | ^~~~~~ 2024-04-19T11:45:38,255 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:13: warning: unused variable ‘errval’ [-Wunused-variable] 2024-04-19T11:45:38,256 763 | int errval=1; 2024-04-19T11:45:38,257 | ^~~~~~ 2024-04-19T11:45:38,257 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-04-19T11:45:38,258 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:17: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:38,259 1011 | if(size3>xfp->buf1size) 2024-04-19T11:45:38,260 | ~~~~~^~~~~~~~~~~~~~ 2024-04-19T11:45:38,260 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:41: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,261 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-04-19T11:45:38,262 | ~~~~~~~~^~~~~~~ 2024-04-19T11:45:38,262 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,263 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-04-19T11:45:38,263 | ~~~~~~~~^~~~~~~ 2024-04-19T11:45:38,264 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,264 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-04-19T11:45:38,265 | ~~~~~~~~^~~~~~~ 2024-04-19T11:45:38,265 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,266 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-04-19T11:45:38,266 | ^ 2024-04-19T11:45:38,267 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:38,268 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-04-19T11:45:38,276 | ~~~~~^~~~~~~~~~~~~~ 2024-04-19T11:45:38,276 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:38,277 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-04-19T11:45:38,287 | ~~~~~^~~~~~~~~~~~~~ 2024-04-19T11:45:38,287 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:25: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:45:38,288 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-04-19T11:45:38,288 | ^ 2024-04-19T11:45:38,289 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:45:38,289 1633 | maxidx = (LASTIDX= __pyx_pybuffernd_forces.diminfo[2].shape)) __pyx_t_4 = 2; 2024-04-19T11:46:18,217 | ^ 2024-04-19T11:46:18,226 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_forces.diminfo[2].shape’ was declared here 2024-04-19T11:46:18,227 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-04-19T11:46:18,227 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,236 moleculekit/fileformats/xtc/trr.c:11555:19: warning: ‘__pyx_pybuffernd_forces.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,237 11555 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_forces.diminfo[1].shape)) __pyx_t_4 = 1; 2024-04-19T11:46:18,238 | ^ 2024-04-19T11:46:18,246 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_forces.diminfo[1].shape’ was declared here 2024-04-19T11:46:18,247 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-04-19T11:46:18,247 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,248 moleculekit/fileformats/xtc/trr.c:2509:95: warning: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,249 2509 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-04-19T11:46:18,249 | ^ 2024-04-19T11:46:18,258 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ was declared here 2024-04-19T11:46:18,259 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-04-19T11:46:18,259 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,269 moleculekit/fileformats/xtc/trr.c:11549:59: warning: ‘__pyx_pybuffernd_forces.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,269 11549 | __pyx_t_28 += __pyx_pybuffernd_forces.diminfo[0].shape; 2024-04-19T11:46:18,270 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-04-19T11:46:18,278 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_forces.diminfo[0].shape’ was declared here 2024-04-19T11:46:18,279 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-04-19T11:46:18,279 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,289 moleculekit/fileformats/xtc/trr.c:11502:19: warning: ‘__pyx_pybuffernd_vel.diminfo[2].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,289 11502 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_vel.diminfo[2].shape)) __pyx_t_4 = 2; 2024-04-19T11:46:18,290 | ^ 2024-04-19T11:46:18,299 moleculekit/fileformats/xtc/trr.c:10107:21: note: ‘__pyx_pybuffernd_vel.diminfo[2].shape’ was declared here 2024-04-19T11:46:18,299 10107 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-04-19T11:46:18,300 | ^~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,309 moleculekit/fileformats/xtc/trr.c:11498:19: warning: ‘__pyx_pybuffernd_vel.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,310 11498 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_vel.diminfo[1].shape)) __pyx_t_4 = 1; 2024-04-19T11:46:18,310 | ^ 2024-04-19T11:46:18,319 moleculekit/fileformats/xtc/trr.c:10107:21: note: ‘__pyx_pybuffernd_vel.diminfo[1].shape’ was declared here 2024-04-19T11:46:18,320 10107 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-04-19T11:46:18,320 | ^~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,321 moleculekit/fileformats/xtc/trr.c:2509:95: warning: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,321 2509 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-04-19T11:46:18,322 | ^ 2024-04-19T11:46:18,331 moleculekit/fileformats/xtc/trr.c:10107:21: note: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ was declared here 2024-04-19T11:46:18,331 10107 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-04-19T11:46:18,332 | ^~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,341 moleculekit/fileformats/xtc/trr.c:11492:56: warning: ‘__pyx_pybuffernd_vel.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,342 11492 | __pyx_t_28 += __pyx_pybuffernd_vel.diminfo[0].shape; 2024-04-19T11:46:18,342 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-04-19T11:46:18,351 moleculekit/fileformats/xtc/trr.c:10107:21: note: ‘__pyx_pybuffernd_vel.diminfo[0].shape’ was declared here 2024-04-19T11:46:18,352 10107 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-04-19T11:46:18,352 | ^~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,362 moleculekit/fileformats/xtc/trr.c:11891:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,362 11891 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_xyz_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-04-19T11:46:18,363 | ^ 2024-04-19T11:46:18,372 moleculekit/fileformats/xtc/trr.c:10113:21: note: ‘__pyx_pybuffernd_xyz_buffer.diminfo[1].shape’ was declared here 2024-04-19T11:46:18,372 10113 | __Pyx_LocalBuf_ND __pyx_pybuffernd_xyz_buffer; 2024-04-19T11:46:18,373 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,382 moleculekit/fileformats/xtc/trr.c:11887:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,383 11887 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_xyz_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-04-19T11:46:18,384 | ^ 2024-04-19T11:46:18,392 moleculekit/fileformats/xtc/trr.c:10113:21: note: ‘__pyx_pybuffernd_xyz_buffer.diminfo[0].shape’ was declared here 2024-04-19T11:46:18,393 10113 | __Pyx_LocalBuf_ND __pyx_pybuffernd_xyz_buffer; 2024-04-19T11:46:18,393 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,403 moleculekit/fileformats/xtc/trr.c:11732:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,404 11732 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_vel_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-04-19T11:46:18,404 | ^ 2024-04-19T11:46:18,413 moleculekit/fileformats/xtc/trr.c:10109:21: note: ‘__pyx_pybuffernd_vel_buffer.diminfo[1].shape’ was declared here 2024-04-19T11:46:18,413 10109 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel_buffer; 2024-04-19T11:46:18,414 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,423 moleculekit/fileformats/xtc/trr.c:11728:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,424 11728 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_vel_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-04-19T11:46:18,424 | ^ 2024-04-19T11:46:18,433 moleculekit/fileformats/xtc/trr.c:10109:21: note: ‘__pyx_pybuffernd_vel_buffer.diminfo[0].shape’ was declared here 2024-04-19T11:46:18,434 10109 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel_buffer; 2024-04-19T11:46:18,434 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,444 moleculekit/fileformats/xtc/trr.c:11784:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[1].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,445 11784 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_forces_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-04-19T11:46:18,445 | ^ 2024-04-19T11:46:18,454 moleculekit/fileformats/xtc/trr.c:10093:21: note: ‘__pyx_pybuffernd_forces_buffer.diminfo[1].shape’ was declared here 2024-04-19T11:46:18,454 10093 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces_buffer; 2024-04-19T11:46:18,455 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:18,464 moleculekit/fileformats/xtc/trr.c:11780:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[0].shape’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:18,465 11780 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_forces_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-04-19T11:46:18,466 | ^ 2024-04-19T11:46:18,474 moleculekit/fileformats/xtc/trr.c:10093:21: note: ‘__pyx_pybuffernd_forces_buffer.diminfo[0].shape’ was declared here 2024-04-19T11:46:18,475 10093 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces_buffer; 2024-04-19T11:46:18,476 | ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-04-19T11:46:25,009 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 2024-04-19T11:46:25,178 building 'moleculekit.dcd' extension 2024-04-19T11:46:25,179 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/dcd 2024-04-19T11:46:25,180 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src 2024-04-19T11:46:25,182 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-ot2ws_un/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 2024-04-19T11:46:25,578 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:46:25,579 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:46:25,579 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:46:25,580 from moleculekit/fileformats/dcd/dcd.c:1256: 2024-04-19T11:46:25,580 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:46:25,581 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:46:25,581 | ^~~~~~~ 2024-04-19T11:46:26,866 In file included from moleculekit/fileformats/dcd/include/dcdplugin.h:1, 2024-04-19T11:46:26,867 from moleculekit/fileformats/dcd/dcd.c:1262: 2024-04-19T11:46:26,868 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-04-19T11:46:26,868 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-04-19T11:46:26,869 | ^~~~~~~~~~~~~ 2024-04-19T11:46:26,869 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-04-19T11:46:26,870 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-04-19T11:46:26,870 | ^~~~~~~~~~~~~~ 2024-04-19T11:46:26,871 moleculekit/fileformats/dcd/include/fastio.h:466:12: warning: ‘fio_write_int32’ defined but not used [-Wunused-function] 2024-04-19T11:46:26,872 466 | static int fio_write_int32(fio_fd fd, int i) { 2024-04-19T11:46:26,872 | ^~~~~~~~~~~~~~~ 2024-04-19T11:46:26,873 moleculekit/fileformats/dcd/include/fastio.h:457:19: warning: ‘fio_ftell’ defined but not used [-Wunused-function] 2024-04-19T11:46:26,873 457 | static fio_size_t fio_ftell(fio_fd fd) { 2024-04-19T11:46:26,874 | ^~~~~~~~~ 2024-04-19T11:46:26,875 moleculekit/fileformats/dcd/include/fastio.h:450:19: warning: ‘fio_fseek’ defined but not used [-Wunused-function] 2024-04-19T11:46:26,875 450 | static fio_size_t fio_fseek(fio_fd fd, fio_size_t offset, int whence) { 2024-04-19T11:46:26,876 | ^~~~~~~~~ 2024-04-19T11:46:26,877 moleculekit/fileformats/dcd/include/fastio.h:415:19: warning: ‘fio_readv’ defined but not used [-Wunused-function] 2024-04-19T11:46:26,878 415 | static fio_size_t fio_readv(fio_fd fd, const fio_iovec * iov, int iovcnt) { 2024-04-19T11:46:26,879 | ^~~~~~~~~ 2024-04-19T11:46:26,880 moleculekit/fileformats/dcd/include/fastio.h:394:12: warning: ‘fio_fclose’ defined but not used [-Wunused-function] 2024-04-19T11:46:26,880 394 | static int fio_fclose(fio_fd fd) { 2024-04-19T11:46:26,881 | ^~~~~~~~~~ 2024-04-19T11:46:26,882 moleculekit/fileformats/dcd/include/fastio.h:366:12: warning: ‘fio_open’ defined but not used [-Wunused-function] 2024-04-19T11:46:26,882 366 | static int fio_open(const char *filename, int mode, fio_fd *fd) { 2024-04-19T11:46:26,883 | ^~~~~~~~ 2024-04-19T11:46:41,293 moleculekit/fileformats/dcd/dcd.c: In function ‘__pyx_pf_11moleculekit_3dcd_17DCDTrajectoryFile_18read’: 2024-04-19T11:46:41,293 moleculekit/fileformats/dcd/dcd.c:1158:40: warning: ‘__pyx_v_i’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:46:41,294 1158 | #define PyInt_FromLong PyLong_FromLong 2024-04-19T11:46:41,295 | ^~~~~~~~~~~~~~~ 2024-04-19T11:46:41,301 moleculekit/fileformats/dcd/dcd.c:8022:7: note: ‘__pyx_v_i’ was declared here 2024-04-19T11:46:41,301 8022 | int __pyx_v_i; 2024-04-19T11:46:41,302 | ^~~~~~~~~ 2024-04-19T11:46:44,682 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-ot2ws_un/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 2024-04-19T11:46:44,901 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdheader’: 2024-04-19T11:46:44,902 moleculekit/fileformats/dcd/src/dcdplugin.c:150:55: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:46:44,903 150 | else if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-04-19T11:46:44,903 | ^~ 2024-04-19T11:46:44,904 moleculekit/fileformats/dcd/src/dcdplugin.c:173:54: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:46:44,905 173 | if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-04-19T11:46:44,905 | ^~ 2024-04-19T11:46:44,906 moleculekit/fileformats/dcd/src/dcdplugin.c:194:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:46:44,907 194 | if (input_integer[0] != dcdcordmagic) 2024-04-19T11:46:44,907 | ^~ 2024-04-19T11:46:44,911 moleculekit/fileformats/dcd/src/dcdplugin.c:409:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:46:44,912 409 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-04-19T11:46:44,913 | ^~ 2024-04-19T11:46:44,914 moleculekit/fileformats/dcd/src/dcdplugin.c:428:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-04-19T11:46:44,914 428 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-04-19T11:46:44,915 | ^~ 2024-04-19T11:46:44,920 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdstep’: 2024-04-19T11:46:44,920 moleculekit/fileformats/dcd/src/dcdplugin.c:651:23: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:46:44,921 651 | if (tmpbuf[i] != sizeof(float) * N) 2024-04-19T11:46:44,922 | ^~ 2024-04-19T11:46:44,922 moleculekit/fileformats/dcd/src/dcdplugin.c:659:49: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-04-19T11:46:44,923 659 | if ((tmpbuf[2 * i] + tmpbuf[2 * i + 1]) != sizeof(float) * N) 2024-04-19T11:46:44,924 | ^~ 2024-04-19T11:46:44,951 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:55: 2024-04-19T11:46:44,952 moleculekit/fileformats/dcd/include/endianswap.h: At top level: 2024-04-19T11:46:44,953 moleculekit/fileformats/dcd/include/endianswap.h:96:13: warning: ‘swap2_aligned’ defined but not used [-Wunused-function] 2024-04-19T11:46:44,953 96 | static void swap2_aligned(void *v, long ndata) { 2024-04-19T11:46:44,955 | ^~~~~~~~~~~~~ 2024-04-19T11:46:44,955 moleculekit/fileformats/dcd/include/endianswap.h:32:13: warning: ‘swap2_unaligned’ defined but not used [-Wunused-function] 2024-04-19T11:46:44,956 32 | static void swap2_unaligned(void *v, long ndata) { 2024-04-19T11:46:44,956 | ^~~~~~~~~~~~~~~ 2024-04-19T11:46:44,957 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:46: 2024-04-19T11:46:44,957 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-04-19T11:46:44,958 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-04-19T11:46:44,958 | ^~~~~~~~~~~~~ 2024-04-19T11:46:44,959 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-04-19T11:46:44,959 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-04-19T11:46:44,960 | ^~~~~~~~~~~~~~ 2024-04-19T11:46:46,237 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 2024-04-19T11:46:46,370 building 'moleculekit.binpos' extension 2024-04-19T11:46:46,371 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/binpos 2024-04-19T11:46:46,371 creating build/temp.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src 2024-04-19T11:46:46,372 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-ot2ws_un/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 2024-04-19T11:46:46,794 In file included from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-04-19T11:46:46,795 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-04-19T11:46:46,795 from /tmp/pip-build-env-ot2ws_un/overlay/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-04-19T11:46:46,796 from moleculekit/fileformats/binpos/binpos.c:1256: 2024-04-19T11:46:46,797 /tmp/pip-build-env-ot2ws_un/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] 2024-04-19T11:46:46,797 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-04-19T11:46:46,798 | ^~~~~~~ 2024-04-19T11:47:01,349 In function ‘__pyx_pf_11moleculekit_6binpos_20BINPOSTrajectoryFile_6_read’, 2024-04-19T11:47:01,350 inlined from ‘__pyx_pw_11moleculekit_6binpos_20BINPOSTrajectoryFile_7_read’ at moleculekit/fileformats/binpos/binpos.c:7504:13: 2024-04-19T11:47:01,358 moleculekit/fileformats/binpos/binpos.c:8045:6: warning: ‘__pyx_v_status’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:47:01,358 8045 | if (__pyx_t_1) { 2024-04-19T11:47:01,359 | ^ 2024-04-19T11:47:01,360 moleculekit/fileformats/binpos/binpos.c: In function ‘__pyx_pw_11moleculekit_6binpos_20BINPOSTrajectoryFile_7_read’: 2024-04-19T11:47:01,366 moleculekit/fileformats/binpos/binpos.c:7522:7: note: ‘__pyx_v_status’ was declared here 2024-04-19T11:47:01,367 7522 | int __pyx_v_status; 2024-04-19T11:47:01,368 | ^~~~~~~~~~~~~~ 2024-04-19T11:47:01,369 moleculekit/fileformats/binpos/binpos.c:1158:40: warning: ‘__pyx_v_i’ may be used uninitialized [-Wmaybe-uninitialized] 2024-04-19T11:47:01,370 1158 | #define PyInt_FromLong PyLong_FromLong 2024-04-19T11:47:01,370 | ^~~~~~~~~~~~~~~ 2024-04-19T11:47:01,377 moleculekit/fileformats/binpos/binpos.c:7519:7: note: ‘__pyx_v_i’ was declared here 2024-04-19T11:47:01,378 7519 | int __pyx_v_i; 2024-04-19T11:47:01,378 | ^~~~~~~~~ 2024-04-19T11:47:04,839 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-ot2ws_un/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 2024-04-19T11:47:05,180 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 2024-04-19T11:47:05,305 building 'moleculekit.tmalign' extension 2024-04-19T11:47:05,306 creating build/temp.linux-armv7l-cpython-311/moleculekit/tmalign 2024-04-19T11:47:05,307 creating build/temp.linux-armv7l-cpython-311/moleculekit/tmalign/src 2024-04-19T11:47:05,308 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-ot2ws_un/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 2024-04-19T11:47:39,172 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-ot2ws_un/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 2024-04-19T11:48:01,668 In file included from /usr/include/c++/12/vector:70, 2024-04-19T11:48:01,668 from moleculekit/tmalign/tmalign_util.cpp:1280: 2024-04-19T11:48:01,669 /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]’: 2024-04-19T11:48:01,669 /usr/include/c++/12/bits/vector.tcc:439:7: note: parameter passing for argument of type ‘std::vector::iterator’ changed in GCC 7.1 2024-04-19T11:48:01,670 439 | vector<_Tp, _Alloc>:: 2024-04-19T11:48:01,671 | ^~~~~~~~~~~~~~~~~~~ 2024-04-19T11:48:02,474 In file included from /usr/include/c++/12/vector:64: 2024-04-19T11:48:02,474 In member function ‘void std::vector<_Tp, _Alloc>::push_back(const value_type&) [with _Tp = double; _Alloc = std::allocator]’, 2024-04-19T11:48:02,475 inlined from ‘PyObject* __pyx_pf_11moleculekit_7tmalign_tmalign(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, std::string, std::string)’ at moleculekit/tmalign/tmalign_util.cpp:20779:32, 2024-04-19T11:48:02,476 inlined from ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/tmalign/tmalign_util.cpp:20264:52: 2024-04-19T11:48:02,477 /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 2024-04-19T11:48:02,478 1287 | _M_realloc_insert(end(), __x); 2024-04-19T11:48:02,478 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-04-19T11:48:02,479 In member function ‘void std::vector<_Tp, _Alloc>::push_back(const value_type&) [with _Tp = double; _Alloc = std::allocator]’, 2024-04-19T11:48:02,479 inlined from ‘PyObject* __pyx_pf_11moleculekit_7tmalign_tmalign(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, std::string, std::string)’ at moleculekit/tmalign/tmalign_util.cpp:20793:33, 2024-04-19T11:48:02,480 inlined from ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/tmalign/tmalign_util.cpp:20264:52: 2024-04-19T11:48:02,480 /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 2024-04-19T11:48:02,481 1287 | _M_realloc_insert(end(), __x); 2024-04-19T11:48:02,481 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-04-19T11:48:02,482 In member function ‘void std::vector<_Tp, _Alloc>::push_back(const value_type&) [with _Tp = double; _Alloc = std::allocator]’, 2024-04-19T11:48:02,482 inlined from ‘PyObject* __pyx_pf_11moleculekit_7tmalign_tmalign(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, std::string, std::string)’ at moleculekit/tmalign/tmalign_util.cpp:20878:34, 2024-04-19T11:48:02,483 inlined from ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’ at moleculekit/tmalign/tmalign_util.cpp:20264:52: 2024-04-19T11:48:02,483 /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 2024-04-19T11:48:02,484 1287 | _M_realloc_insert(end(), __x); 2024-04-19T11:48:02,484 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-04-19T11:48:04,873 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 2024-04-19T11:48:05,255 UPDATING build/lib.linux-armv7l-cpython-311/moleculekit/_version.py 2024-04-19T11:48:05,255 set build/lib.linux-armv7l-cpython-311/moleculekit/_version.py to '1.8.31' 2024-04-19T11:48:05,256 installing to build/bdist.linux-armv7l/wheel 2024-04-19T11:48:05,256 running install 2024-04-19T11:48:05,280 running install_lib 2024-04-19T11:48:05,286 creating build/bdist.linux-armv7l 2024-04-19T11:48:05,286 creating build/bdist.linux-armv7l/wheel 2024-04-19T11:48:05,289 creating build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,290 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,293 copying build/lib.linux-armv7l-cpython-311/moleculekit/version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,295 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-04-19T11:48:05,297 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-04-19T11:48:05,299 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-04-19T11:48:05,300 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/src/dcdplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-04-19T11:48:05,303 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcd.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-04-19T11:48:05,306 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcd.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-04-19T11:48:05,321 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/dcdlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-04-19T11:48:05,323 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-04-19T11:48:05,324 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/dcdplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-04-19T11:48:05,326 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/fastio.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-04-19T11:48:05,329 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-04-19T11:48:05,331 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/endianswap.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-04-19T11:48:05,333 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-04-19T11:48:05,337 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/utils.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-04-19T11:48:05,339 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-04-19T11:48:05,341 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-04-19T11:48:05,342 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/src/binposplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-04-19T11:48:05,345 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binposlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-04-19T11:48:05,347 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binpos.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-04-19T11:48:05,349 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/binpos.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-04-19T11:48:05,364 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-04-19T11:48:05,365 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-04-19T11:48:05,367 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include/binposplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-04-19T11:48:05,369 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-04-19T11:48:05,372 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-04-19T11:48:05,375 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-04-19T11:48:05,376 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-04-19T11:48:05,378 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-04-19T11:48:05,381 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-04-19T11:48:05,384 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-04-19T11:48:05,386 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdr_seek.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-04-19T11:48:05,388 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-04-19T11:48:05,391 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/trr.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-04-19T11:48:05,394 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-04-19T11:48:05,414 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-04-19T11:48:05,443 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xdrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-04-19T11:48:05,445 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/trrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-04-19T11:48:05,448 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-04-19T11:48:05,450 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/trr_header.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-04-19T11:48:05,452 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdr_seek.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-04-19T11:48:05,455 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-04-19T11:48:05,457 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-04-19T11:48:05,460 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xdrfile.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-04-19T11:48:05,463 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/include/xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-04-19T11:48:05,466 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xtc.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-04-19T11:48:05,468 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/xtc/xtclib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-04-19T11:48:05,471 copying build/lib.linux-armv7l-cpython-311/moleculekit/fileformats/netcdf.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-04-19T11:48:05,474 copying build/lib.linux-armv7l-cpython-311/moleculekit/vmdgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,477 copying build/lib.linux-armv7l-cpython-311/moleculekit/wrapping.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,508 copying build/lib.linux-armv7l-cpython-311/moleculekit/dihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,510 copying build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,531 copying build/lib.linux-armv7l-cpython-311/moleculekit/rdkitintegration.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,533 creating build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-04-19T11:48:05,534 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils/distance_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-04-19T11:48:05,537 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils/distance_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-04-19T11:48:05,559 creating build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,560 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricgyration.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,562 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,564 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metriccoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,566 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricsasa.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,569 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricfluctuation.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,571 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricsecondarystructure.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,573 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metrictmscore.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,575 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricplumed2.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,578 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricshell.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,580 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,582 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/projection.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,584 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricdihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,586 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricdistance.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,589 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricrmsd.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,591 copying build/lib.linux-armv7l-cpython-311/moleculekit/projections/metricsphericalcoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-04-19T11:48:05,593 copying build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,615 copying build/lib.linux-armv7l-cpython-311/moleculekit/vmdviewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,618 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-04-19T11:48:05,619 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-04-19T11:48:05,641 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/interactions.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-04-19T11:48:05,644 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-04-19T11:48:05,645 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole/sigmahole.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-04-19T11:48:05,666 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/sigmahole/sigmahole.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-04-19T11:48:05,668 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-04-19T11:48:05,691 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-04-19T11:48:05,719 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-04-19T11:48:05,720 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds/hbonds.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-04-19T11:48:05,722 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/hbonds/hbonds.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-04-19T11:48:05,740 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-04-19T11:48:05,765 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-04-19T11:48:05,767 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-04-19T11:48:05,768 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi/cationpi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-04-19T11:48:05,771 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/cationpi/cationpi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-04-19T11:48:05,790 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-04-19T11:48:05,791 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi/pipi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-04-19T11:48:05,793 copying build/lib.linux-armv7l-cpython-311/moleculekit/interactions/pipi/pipi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-04-19T11:48:05,813 creating build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-04-19T11:48:05,814 copying build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils/cython_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-04-19T11:48:05,817 copying build/lib.linux-armv7l-cpython-311/moleculekit/cython_utils/cython_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-04-19T11:48:05,836 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,862 copying build/lib.linux-armv7l-cpython-311/moleculekit/util.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,864 copying build/lib.linux-armv7l-cpython-311/moleculekit/molecule.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,869 copying build/lib.linux-armv7l-cpython-311/moleculekit/binpos.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,880 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,903 copying build/lib.linux-armv7l-cpython-311/moleculekit/rcsb.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,905 copying build/lib.linux-armv7l-cpython-311/moleculekit/pymolgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,907 copying build/lib.linux-armv7l-cpython-311/moleculekit/opm.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,909 copying build/lib.linux-armv7l-cpython-311/moleculekit/xtc.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,933 copying build/lib.linux-armv7l-cpython-311/moleculekit/logging.ini -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,935 copying build/lib.linux-armv7l-cpython-311/moleculekit/viewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,937 copying build/lib.linux-armv7l-cpython-311/moleculekit/trr.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,961 copying build/lib.linux-armv7l-cpython-311/moleculekit/distance.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,963 copying build/lib.linux-armv7l-cpython-311/moleculekit/align.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:05,965 creating build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-04-19T11:48:05,967 copying build/lib.linux-armv7l-cpython-311/moleculekit/wrapping/wrapping.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-04-19T11:48:05,988 copying build/lib.linux-armv7l-cpython-311/moleculekit/wrapping/wrapping.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-04-19T11:48:05,991 creating build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-04-19T11:48:05,992 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-04-19T11:48:06,012 copying build/lib.linux-armv7l-cpython-311/moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-04-19T11:48:06,014 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,061 copying build/lib.linux-armv7l-cpython-311/moleculekit/_version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,063 copying build/lib.linux-armv7l-cpython-311/moleculekit/vmd_wrapper -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,065 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-04-19T11:48:06,067 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-04-19T11:48:06,069 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/src/TMAlign.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-04-19T11:48:06,074 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/tmalign_util.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-04-19T11:48:06,092 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/tmalignlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-04-19T11:48:06,094 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-04-19T11:48:06,095 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/include/TMAlign.h -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-04-19T11:48:06,097 copying build/lib.linux-armv7l-cpython-311/moleculekit/tmalign/tmalign_util.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-04-19T11:48:06,100 copying build/lib.linux-armv7l-cpython-311/moleculekit/config.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,101 copying build/lib.linux-armv7l-cpython-311/moleculekit/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,103 creating build/bdist.linux-armv7l/wheel/moleculekit/share 2024-04-19T11:48:06,104 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/opm_sequences.json -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-04-19T11:48:06,295 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/ALA.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-04-19T11:48:06,298 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr 2024-04-19T11:48:06,302 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,303 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DPP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,305 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,308 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TPO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,310 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DA2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,312 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,315 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,317 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4IN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,319 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,321 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,323 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,325 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,327 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,329 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0A1.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,332 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2ML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,334 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DA2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,336 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HHK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,338 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/1MH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,340 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,343 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/APD.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,345 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,347 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HHK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,349 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ME0.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,352 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ESC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,354 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,356 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,358 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,360 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PRK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,363 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NAL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,365 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,367 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CGU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,369 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4IN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,371 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,374 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MMO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,376 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,378 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2GX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,381 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2ML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,383 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,385 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0AF.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,388 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IIL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,390 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NZC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,392 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/.gitkeep -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,394 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,396 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAB.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,399 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,401 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GHG.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,403 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/004.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,405 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HOX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,408 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,410 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/KYN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,413 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OMX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,415 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,417 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/1MH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,419 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,421 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0A1.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,423 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PCA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,425 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ONL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,428 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,430 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,432 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PRK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,434 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ORM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,437 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,439 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,441 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HYP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,443 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/FGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,445 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TY2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,448 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/SEP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,450 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/P1L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,452 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ABA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,454 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CGU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,456 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAB.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,458 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AHP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,461 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/03Y.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,463 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,465 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/004.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,468 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,470 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,472 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HYP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,475 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/D4P.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,477 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DAH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,479 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MMO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,481 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,484 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,486 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YNM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,488 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,490 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,492 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ESC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,494 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GNC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,497 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BTK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,500 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NAL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,502 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/I2M.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,504 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0BN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,506 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,509 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,511 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HPE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,513 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/SEP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,515 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,517 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,519 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,521 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TRO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,523 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/DPP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,525 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ME0.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,527 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,529 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BB8.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,532 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/KYN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,534 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,536 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,538 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/5JP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,540 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,542 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,544 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YNM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,546 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BB8.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,548 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/PCA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,550 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HQA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,553 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ORM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,554 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,557 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/M3L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,559 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2GX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,561 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,563 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,565 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TPO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,567 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NZC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,569 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2MR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,572 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,574 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/P1L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,576 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0AF.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,578 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/03Y.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,581 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AA4.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,583 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,585 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/5JP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,588 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GHG.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,590 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2AS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,592 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ONL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,594 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YCM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,597 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HPE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,599 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,601 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,603 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,605 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ABA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,608 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,610 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TRO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,612 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/FGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,614 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,617 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/I2M.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,619 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/BTK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,621 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,623 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,625 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/LME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,627 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2MR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,629 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,632 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IIL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,634 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,636 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/ALC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,638 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/OMX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,640 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/M3L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,643 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MEA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,645 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/MLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,647 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,649 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HQA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,652 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/APD.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,654 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/0BN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,656 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/NVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,658 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,661 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TY2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,662 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/YCM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,664 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HLU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,666 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/GNC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,669 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/HOX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,671 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AHP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,673 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/2AS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,675 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/AA4.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,677 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,679 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/D4P.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,681 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/IML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,683 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,685 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/pdb2pqr/residues/CSA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-04-19T11:48:06,688 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/backbone.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-04-19T11:48:06,690 creating build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-04-19T11:48:06,692 copying build/lib.linux-armv7l-cpython-311/moleculekit/share/atomselect/atomselect.json -> build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-04-19T11:48:06,694 copying build/lib.linux-armv7l-cpython-311/moleculekit/readers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,699 copying build/lib.linux-armv7l-cpython-311/moleculekit/dcd.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,714 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-04-19T11:48:06,715 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/atomselect.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-04-19T11:48:06,718 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/analyze.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-04-19T11:48:06,720 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-04-19T11:48:06,722 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect/languageparser.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-04-19T11:48:06,724 copying build/lib.linux-armv7l-cpython-311/moleculekit/writers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,728 creating build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-04-19T11:48:06,729 copying build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils/occupancy_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-04-19T11:48:06,748 copying build/lib.linux-armv7l-cpython-311/moleculekit/occupancy_utils/occupancy_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-04-19T11:48:06,750 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-04-19T11:48:06,751 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils/atomselect_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-04-19T11:48:06,774 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils/atomselect_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-04-19T11:48:06,777 copying build/lib.linux-armv7l-cpython-311/moleculekit/periodictable.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,780 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-04-19T11:48:06,780 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/test_smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-04-19T11:48:06,783 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/smallmolcdp.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-04-19T11:48:06,785 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-04-19T11:48:06,788 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/test_smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-04-19T11:48:06,790 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-04-19T11:48:06,793 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-04-19T11:48:06,795 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-04-19T11:48:06,798 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-04-19T11:48:06,799 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/restrainedembed.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-04-19T11:48:06,801 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/clustering.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-04-19T11:48:06,803 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-04-19T11:48:06,805 copying build/lib.linux-armv7l-cpython-311/moleculekit/smallmol/tools/test_tools.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-04-19T11:48:06,808 copying build/lib.linux-armv7l-cpython-311/moleculekit/atomselect_utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,832 creating build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,833 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/autosegment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,835 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/preparation_customres.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,838 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/docking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,840 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/voxeldescriptors.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,842 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/modelling.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,845 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/graphalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,848 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/crystalpacking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,850 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/preparation.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,853 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/moleculechecks.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,855 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,857 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/sequencestructuralalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,859 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/detect.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,862 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/hhblitsprofile.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,864 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/atomtyper.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-04-19T11:48:06,866 creating build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-04-19T11:48:06,867 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools/obabel_cli.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-04-19T11:48:06,869 copying build/lib.linux-armv7l-cpython-311/moleculekit/tools/obabel_tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-04-19T11:48:06,871 creating build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-04-19T11:48:06,872 copying build/lib.linux-armv7l-cpython-311/moleculekit/ply/lex.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-04-19T11:48:06,875 copying build/lib.linux-armv7l-cpython-311/moleculekit/ply/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-04-19T11:48:06,877 copying build/lib.linux-armv7l-cpython-311/moleculekit/ply/yacc.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-04-19T11:48:06,881 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-04-19T11:48:06,882 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-04-19T11:48:06,883 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer/PdbxWriter.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-04-19T11:48:06,886 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/writer/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-04-19T11:48:06,888 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-04-19T11:48:06,889 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/PdbxWriterTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-04-19T11:48:06,891 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-04-19T11:48:06,893 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/PdbxReaderTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-04-19T11:48:06,895 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/tests/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-04-19T11:48:06,896 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-04-19T11:48:06,898 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-04-19T11:48:06,900 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/PdbxReader.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-04-19T11:48:06,902 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/PdbxParser.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-04-19T11:48:06,905 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-04-19T11:48:06,906 copying build/lib.linux-armv7l-cpython-311/moleculekit/pdbx/reader/PdbxContainers.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-04-19T11:48:06,908 copying build/lib.linux-armv7l-cpython-311/moleculekit/home.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-04-19T11:48:06,910 running install_egg_info 2024-04-19T11:48:06,915 Copying moleculekit.egg-info to build/bdist.linux-armv7l/wheel/moleculekit-1.8.31-py3.11.egg-info 2024-04-19T11:48:06,927 running install_scripts 2024-04-19T11:48:06,998 creating build/bdist.linux-armv7l/wheel/moleculekit-1.8.31.dist-info/WHEEL 2024-04-19T11:48:07,001 creating '/tmp/pip-wheel-har0ro7r/.tmp-w33gwty1/moleculekit-1.8.31-cp311-cp311-linux_armv7l.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2024-04-19T11:48:07,005 adding 'moleculekit/__init__.py' 2024-04-19T11:48:07,007 adding 'moleculekit/_version.py' 2024-04-19T11:48:07,009 adding 'moleculekit/align.py' 2024-04-19T11:48:07,337 adding 'moleculekit/atomselect_utils.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:07,497 adding 'moleculekit/binpos.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:07,503 adding 'moleculekit/bondguesser.py' 2024-04-19T11:48:07,748 adding 'moleculekit/bondguesser_utils.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:07,756 adding 'moleculekit/config.py' 2024-04-19T11:48:08,016 adding 'moleculekit/cython_utils.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:08,177 adding 'moleculekit/dcd.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:08,182 adding 'moleculekit/dihedral.py' 2024-04-19T11:48:08,184 adding 'moleculekit/distance.py' 2024-04-19T11:48:08,502 adding 'moleculekit/distance_utils.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:08,513 adding 'moleculekit/home.py' 2024-04-19T11:48:08,514 adding 'moleculekit/logging.ini' 2024-04-19T11:48:08,528 adding 'moleculekit/molecule.py' 2024-04-19T11:48:08,757 adding 'moleculekit/occupancy_utils.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:08,765 adding 'moleculekit/opm.py' 2024-04-19T11:48:08,768 adding 'moleculekit/periodictable.py' 2024-04-19T11:48:08,769 adding 'moleculekit/pymolgraphics.py' 2024-04-19T11:48:08,770 adding 'moleculekit/rcsb.py' 2024-04-19T11:48:08,772 adding 'moleculekit/rdkitintegration.py' 2024-04-19T11:48:08,785 adding 'moleculekit/readers.py' 2024-04-19T11:48:09,384 adding 'moleculekit/tmalign.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:09,687 adding 'moleculekit/trr.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:09,699 adding 'moleculekit/util.py' 2024-04-19T11:48:09,700 adding 'moleculekit/version.py' 2024-04-19T11:48:09,702 adding 'moleculekit/viewer.py' 2024-04-19T11:48:09,703 adding 'moleculekit/vmd_wrapper' 2024-04-19T11:48:09,705 adding 'moleculekit/vmdgraphics.py' 2024-04-19T11:48:09,707 adding 'moleculekit/vmdviewer.py' 2024-04-19T11:48:09,961 adding 'moleculekit/wrapping.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:09,975 adding 'moleculekit/writers.py' 2024-04-19T11:48:10,236 adding 'moleculekit/xtc.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:10,245 adding 'moleculekit/atomselect/__init__.py' 2024-04-19T11:48:10,246 adding 'moleculekit/atomselect/analyze.py' 2024-04-19T11:48:10,249 adding 'moleculekit/atomselect/atomselect.py' 2024-04-19T11:48:10,251 adding 'moleculekit/atomselect/languageparser.py' 2024-04-19T11:48:10,354 adding 'moleculekit/atomselect_utils/atomselect_utils.cpp' 2024-04-19T11:48:10,365 adding 'moleculekit/atomselect_utils/atomselect_utils.pyx' 2024-04-19T11:48:10,456 adding 'moleculekit/bondguesser_utils/bondguesser_utils.cpp' 2024-04-19T11:48:10,465 adding 'moleculekit/bondguesser_utils/bondguesser_utils.pyx' 2024-04-19T11:48:10,553 adding 'moleculekit/cython_utils/cython_utils.cpp' 2024-04-19T11:48:10,562 adding 'moleculekit/cython_utils/cython_utils.pyx' 2024-04-19T11:48:10,664 adding 'moleculekit/distance_utils/distance_utils.cpp' 2024-04-19T11:48:10,675 adding 'moleculekit/distance_utils/distance_utils.pyx' 2024-04-19T11:48:10,676 adding 'moleculekit/fileformats/__init__.py' 2024-04-19T11:48:10,681 adding 'moleculekit/fileformats/netcdf.py' 2024-04-19T11:48:10,683 adding 'moleculekit/fileformats/utils.py' 2024-04-19T11:48:10,743 adding 'moleculekit/fileformats/binpos/binpos.c' 2024-04-19T11:48:10,750 adding 'moleculekit/fileformats/binpos/binpos.pyx' 2024-04-19T11:48:10,752 adding 'moleculekit/fileformats/binpos/binposlib.pxd' 2024-04-19T11:48:10,753 adding 'moleculekit/fileformats/binpos/include/binposplugin.h' 2024-04-19T11:48:10,754 adding 'moleculekit/fileformats/binpos/include/largefiles.h' 2024-04-19T11:48:10,760 adding 'moleculekit/fileformats/binpos/include/molfile_plugin.h' 2024-04-19T11:48:10,762 adding 'moleculekit/fileformats/binpos/src/binposplugin.c' 2024-04-19T11:48:10,825 adding 'moleculekit/fileformats/dcd/dcd.c' 2024-04-19T11:48:10,832 adding 'moleculekit/fileformats/dcd/dcd.pyx' 2024-04-19T11:48:10,834 adding 'moleculekit/fileformats/dcd/dcdlib.pxd' 2024-04-19T11:48:10,835 adding 'moleculekit/fileformats/dcd/include/dcdplugin.h' 2024-04-19T11:48:10,837 adding 'moleculekit/fileformats/dcd/include/endianswap.h' 2024-04-19T11:48:10,839 adding 'moleculekit/fileformats/dcd/include/fastio.h' 2024-04-19T11:48:10,840 adding 'moleculekit/fileformats/dcd/include/largefiles.h' 2024-04-19T11:48:10,845 adding 'moleculekit/fileformats/dcd/include/molfile_plugin.h' 2024-04-19T11:48:10,850 adding 'moleculekit/fileformats/dcd/src/dcdplugin.c' 2024-04-19T11:48:10,944 adding 'moleculekit/fileformats/xtc/trr.c' 2024-04-19T11:48:10,956 adding 'moleculekit/fileformats/xtc/trr.pyx' 2024-04-19T11:48:10,957 adding 'moleculekit/fileformats/xtc/trrlib.pxd' 2024-04-19T11:48:10,958 adding 'moleculekit/fileformats/xtc/xdrlib.pxd' 2024-04-19T11:48:11,047 adding 'moleculekit/fileformats/xtc/xtc.cpp' 2024-04-19T11:48:11,055 adding 'moleculekit/fileformats/xtc/xtc.pyx' 2024-04-19T11:48:11,056 adding 'moleculekit/fileformats/xtc/xtclib.pxd' 2024-04-19T11:48:11,058 adding 'moleculekit/fileformats/xtc/include/trr_header.h' 2024-04-19T11:48:11,059 adding 'moleculekit/fileformats/xtc/include/xdr_seek.h' 2024-04-19T11:48:11,062 adding 'moleculekit/fileformats/xtc/include/xdrfile.h' 2024-04-19T11:48:11,063 adding 'moleculekit/fileformats/xtc/include/xdrfile_trr.h' 2024-04-19T11:48:11,064 adding 'moleculekit/fileformats/xtc/include/xdrfile_xtc.h' 2024-04-19T11:48:11,066 adding 'moleculekit/fileformats/xtc/include/xtc.h' 2024-04-19T11:48:11,067 adding 'moleculekit/fileformats/xtc/src/xdr_seek.c' 2024-04-19T11:48:11,074 adding 'moleculekit/fileformats/xtc/src/xdrfile.cpp' 2024-04-19T11:48:11,076 adding 'moleculekit/fileformats/xtc/src/xdrfile_trr.c' 2024-04-19T11:48:11,078 adding 'moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp' 2024-04-19T11:48:11,080 adding 'moleculekit/fileformats/xtc/src/xtc.cpp' 2024-04-19T11:48:11,082 adding 'moleculekit/interactions/__init__.py' 2024-04-19T11:48:11,362 adding 'moleculekit/interactions/cationpi.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:11,628 adding 'moleculekit/interactions/hbonds.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:11,639 adding 'moleculekit/interactions/interactions.py' 2024-04-19T11:48:11,916 adding 'moleculekit/interactions/pipi.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:12,198 adding 'moleculekit/interactions/sigmahole.cpython-311-arm-linux-gnueabihf.so' 2024-04-19T11:48:12,298 adding 'moleculekit/interactions/cationpi/cationpi.cpp' 2024-04-19T11:48:12,307 adding 'moleculekit/interactions/cationpi/cationpi.pyx' 2024-04-19T11:48:12,397 adding 'moleculekit/interactions/hbonds/hbonds.cpp' 2024-04-19T11:48:12,406 adding 'moleculekit/interactions/hbonds/hbonds.pyx' 2024-04-19T11:48:12,511 adding 'moleculekit/interactions/pipi/pipi.cpp' 2024-04-19T11:48:12,520 adding 'moleculekit/interactions/pipi/pipi.pyx' 2024-04-19T11:48:12,610 adding 'moleculekit/interactions/sigmahole/sigmahole.cpp' 2024-04-19T11:48:12,619 adding 'moleculekit/interactions/sigmahole/sigmahole.pyx' 2024-04-19T11:48:12,706 adding 'moleculekit/occupancy_utils/occupancy_utils.cpp' 2024-04-19T11:48:12,714 adding 'moleculekit/occupancy_utils/occupancy_utils.pyx' 2024-04-19T11:48:12,715 adding 'moleculekit/pdbx/__init__.py' 2024-04-19T11:48:12,719 adding 'moleculekit/pdbx/reader/PdbxContainers.py' 2024-04-19T11:48:12,722 adding 'moleculekit/pdbx/reader/PdbxParser.py' 2024-04-19T11:48:12,724 adding 'moleculekit/pdbx/reader/PdbxReader.py' 2024-04-19T11:48:12,725 adding 'moleculekit/pdbx/reader/__init__.py' 2024-04-19T11:48:12,727 adding 'moleculekit/pdbx/tests/PdbxReadWriteTests.py' 2024-04-19T11:48:12,729 adding 'moleculekit/pdbx/tests/PdbxReaderTests.py' 2024-04-19T11:48:12,730 adding 'moleculekit/pdbx/tests/PdbxWriterTests.py' 2024-04-19T11:48:12,731 adding 'moleculekit/pdbx/tests/__init__.py' 2024-04-19T11:48:12,733 adding 'moleculekit/pdbx/writer/PdbxWriter.py' 2024-04-19T11:48:12,734 adding 'moleculekit/pdbx/writer/__init__.py' 2024-04-19T11:48:12,736 adding 'moleculekit/ply/__init__.py' 2024-04-19T11:48:12,740 adding 'moleculekit/ply/lex.py' 2024-04-19T11:48:12,752 adding 'moleculekit/ply/yacc.py' 2024-04-19T11:48:12,754 adding 'moleculekit/projections/__init__.py' 2024-04-19T11:48:12,756 adding 'moleculekit/projections/metriccoordinate.py' 2024-04-19T11:48:12,759 adding 'moleculekit/projections/metricdihedral.py' 2024-04-19T11:48:12,763 adding 'moleculekit/projections/metricdistance.py' 2024-04-19T11:48:12,765 adding 'moleculekit/projections/metricfluctuation.py' 2024-04-19T11:48:12,767 adding 'moleculekit/projections/metricgyration.py' 2024-04-19T11:48:12,771 adding 'moleculekit/projections/metricplumed2.py' 2024-04-19T11:48:12,772 adding 'moleculekit/projections/metricrmsd.py' 2024-04-19T11:48:12,775 adding 'moleculekit/projections/metricsasa.py' 2024-04-19T11:48:12,777 adding 'moleculekit/projections/metricsecondarystructure.py' 2024-04-19T11:48:12,778 adding 'moleculekit/projections/metricshell.py' 2024-04-19T11:48:12,780 adding 'moleculekit/projections/metricsphericalcoordinate.py' 2024-04-19T11:48:12,781 adding 'moleculekit/projections/metrictmscore.py' 2024-04-19T11:48:12,783 adding 'moleculekit/projections/projection.py' 2024-04-19T11:48:12,784 adding 'moleculekit/projections/util.py' 2024-04-19T11:48:12,786 adding 'moleculekit/share/ALA.cif' 2024-04-19T11:48:12,788 adding 'moleculekit/share/backbone.cif' 2024-04-19T11:48:14,250 adding 'moleculekit/share/opm_sequences.json' 2024-04-19T11:48:14,335 adding 'moleculekit/share/atomselect/atomselect.json' 2024-04-19T11:48:14,339 adding 'moleculekit/share/pdb2pqr/residues/.gitkeep' 2024-04-19T11:48:14,340 adding 'moleculekit/share/pdb2pqr/residues/004.dat' 2024-04-19T11:48:14,342 adding 'moleculekit/share/pdb2pqr/residues/004.xml' 2024-04-19T11:48:14,343 adding 'moleculekit/share/pdb2pqr/residues/03Y.dat' 2024-04-19T11:48:14,344 adding 'moleculekit/share/pdb2pqr/residues/03Y.xml' 2024-04-19T11:48:14,345 adding 'moleculekit/share/pdb2pqr/residues/0A1.dat' 2024-04-19T11:48:14,346 adding 'moleculekit/share/pdb2pqr/residues/0A1.xml' 2024-04-19T11:48:14,348 adding 'moleculekit/share/pdb2pqr/residues/0AF.dat' 2024-04-19T11:48:14,349 adding 'moleculekit/share/pdb2pqr/residues/0AF.xml' 2024-04-19T11:48:14,350 adding 'moleculekit/share/pdb2pqr/residues/0BN.dat' 2024-04-19T11:48:14,351 adding 'moleculekit/share/pdb2pqr/residues/0BN.xml' 2024-04-19T11:48:14,353 adding 'moleculekit/share/pdb2pqr/residues/1MH.dat' 2024-04-19T11:48:14,354 adding 'moleculekit/share/pdb2pqr/residues/1MH.xml' 2024-04-19T11:48:14,355 adding 'moleculekit/share/pdb2pqr/residues/2AS.dat' 2024-04-19T11:48:14,356 adding 'moleculekit/share/pdb2pqr/residues/2AS.xml' 2024-04-19T11:48:14,357 adding 'moleculekit/share/pdb2pqr/residues/2GX.dat' 2024-04-19T11:48:14,359 adding 'moleculekit/share/pdb2pqr/residues/2GX.xml' 2024-04-19T11:48:14,360 adding 'moleculekit/share/pdb2pqr/residues/2ML.dat' 2024-04-19T11:48:14,361 adding 'moleculekit/share/pdb2pqr/residues/2ML.xml' 2024-04-19T11:48:14,362 adding 'moleculekit/share/pdb2pqr/residues/2MR.dat' 2024-04-19T11:48:14,363 adding 'moleculekit/share/pdb2pqr/residues/2MR.xml' 2024-04-19T11:48:14,364 adding 'moleculekit/share/pdb2pqr/residues/4IN.dat' 2024-04-19T11:48:14,366 adding 'moleculekit/share/pdb2pqr/residues/4IN.xml' 2024-04-19T11:48:14,367 adding 'moleculekit/share/pdb2pqr/residues/4PH.dat' 2024-04-19T11:48:14,368 adding 'moleculekit/share/pdb2pqr/residues/4PH.xml' 2024-04-19T11:48:14,369 adding 'moleculekit/share/pdb2pqr/residues/4PQ.dat' 2024-04-19T11:48:14,370 adding 'moleculekit/share/pdb2pqr/residues/4PQ.xml' 2024-04-19T11:48:14,371 adding 'moleculekit/share/pdb2pqr/residues/5JP.dat' 2024-04-19T11:48:14,373 adding 'moleculekit/share/pdb2pqr/residues/5JP.xml' 2024-04-19T11:48:14,374 adding 'moleculekit/share/pdb2pqr/residues/AA4.dat' 2024-04-19T11:48:14,375 adding 'moleculekit/share/pdb2pqr/residues/AA4.xml' 2024-04-19T11:48:14,376 adding 'moleculekit/share/pdb2pqr/residues/ABA.dat' 2024-04-19T11:48:14,378 adding 'moleculekit/share/pdb2pqr/residues/ABA.xml' 2024-04-19T11:48:14,379 adding 'moleculekit/share/pdb2pqr/residues/AHP.dat' 2024-04-19T11:48:14,380 adding 'moleculekit/share/pdb2pqr/residues/AHP.xml' 2024-04-19T11:48:14,381 adding 'moleculekit/share/pdb2pqr/residues/ALC.dat' 2024-04-19T11:48:14,382 adding 'moleculekit/share/pdb2pqr/residues/ALC.xml' 2024-04-19T11:48:14,383 adding 'moleculekit/share/pdb2pqr/residues/ALN.dat' 2024-04-19T11:48:14,385 adding 'moleculekit/share/pdb2pqr/residues/ALN.xml' 2024-04-19T11:48:14,386 adding 'moleculekit/share/pdb2pqr/residues/ALY.dat' 2024-04-19T11:48:14,387 adding 'moleculekit/share/pdb2pqr/residues/ALY.xml' 2024-04-19T11:48:14,388 adding 'moleculekit/share/pdb2pqr/residues/APD.dat' 2024-04-19T11:48:14,389 adding 'moleculekit/share/pdb2pqr/residues/APD.xml' 2024-04-19T11:48:14,391 adding 'moleculekit/share/pdb2pqr/residues/BB8.dat' 2024-04-19T11:48:14,392 adding 'moleculekit/share/pdb2pqr/residues/BB8.xml' 2024-04-19T11:48:14,393 adding 'moleculekit/share/pdb2pqr/residues/BCS.dat' 2024-04-19T11:48:14,394 adding 'moleculekit/share/pdb2pqr/residues/BCS.xml' 2024-04-19T11:48:14,396 adding 'moleculekit/share/pdb2pqr/residues/BTK.dat' 2024-04-19T11:48:14,397 adding 'moleculekit/share/pdb2pqr/residues/BTK.xml' 2024-04-19T11:48:14,398 adding 'moleculekit/share/pdb2pqr/residues/CCS.dat' 2024-04-19T11:48:14,399 adding 'moleculekit/share/pdb2pqr/residues/CCS.xml' 2024-04-19T11:48:14,400 adding 'moleculekit/share/pdb2pqr/residues/CGU.dat' 2024-04-19T11:48:14,402 adding 'moleculekit/share/pdb2pqr/residues/CGU.xml' 2024-04-19T11:48:14,403 adding 'moleculekit/share/pdb2pqr/residues/CSA.dat' 2024-04-19T11:48:14,404 adding 'moleculekit/share/pdb2pqr/residues/CSA.xml' 2024-04-19T11:48:14,405 adding 'moleculekit/share/pdb2pqr/residues/CSO.dat' 2024-04-19T11:48:14,406 adding 'moleculekit/share/pdb2pqr/residues/CSO.xml' 2024-04-19T11:48:14,408 adding 'moleculekit/share/pdb2pqr/residues/CSP.dat' 2024-04-19T11:48:14,409 adding 'moleculekit/share/pdb2pqr/residues/CSP.xml' 2024-04-19T11:48:14,410 adding 'moleculekit/share/pdb2pqr/residues/CSS.dat' 2024-04-19T11:48:14,411 adding 'moleculekit/share/pdb2pqr/residues/CSS.xml' 2024-04-19T11:48:14,412 adding 'moleculekit/share/pdb2pqr/residues/D4P.dat' 2024-04-19T11:48:14,414 adding 'moleculekit/share/pdb2pqr/residues/D4P.xml' 2024-04-19T11:48:14,415 adding 'moleculekit/share/pdb2pqr/residues/DA2.dat' 2024-04-19T11:48:14,416 adding 'moleculekit/share/pdb2pqr/residues/DA2.xml' 2024-04-19T11:48:14,417 adding 'moleculekit/share/pdb2pqr/residues/DAB.dat' 2024-04-19T11:48:14,418 adding 'moleculekit/share/pdb2pqr/residues/DAB.xml' 2024-04-19T11:48:14,420 adding 'moleculekit/share/pdb2pqr/residues/DAH.dat' 2024-04-19T11:48:14,421 adding 'moleculekit/share/pdb2pqr/residues/DAH.xml' 2024-04-19T11:48:14,422 adding 'moleculekit/share/pdb2pqr/residues/DPP.dat' 2024-04-19T11:48:14,423 adding 'moleculekit/share/pdb2pqr/residues/DPP.xml' 2024-04-19T11:48:14,424 adding 'moleculekit/share/pdb2pqr/residues/ESC.dat' 2024-04-19T11:48:14,425 adding 'moleculekit/share/pdb2pqr/residues/ESC.xml' 2024-04-19T11:48:14,426 adding 'moleculekit/share/pdb2pqr/residues/FGL.dat' 2024-04-19T11:48:14,427 adding 'moleculekit/share/pdb2pqr/residues/FGL.xml' 2024-04-19T11:48:14,428 adding 'moleculekit/share/pdb2pqr/residues/GHG.dat' 2024-04-19T11:48:14,430 adding 'moleculekit/share/pdb2pqr/residues/GHG.xml' 2024-04-19T11:48:14,431 adding 'moleculekit/share/pdb2pqr/residues/GME.dat' 2024-04-19T11:48:14,432 adding 'moleculekit/share/pdb2pqr/residues/GME.xml' 2024-04-19T11:48:14,433 adding 'moleculekit/share/pdb2pqr/residues/GNC.dat' 2024-04-19T11:48:14,434 adding 'moleculekit/share/pdb2pqr/residues/GNC.xml' 2024-04-19T11:48:14,435 adding 'moleculekit/share/pdb2pqr/residues/HHK.dat' 2024-04-19T11:48:14,437 adding 'moleculekit/share/pdb2pqr/residues/HHK.xml' 2024-04-19T11:48:14,438 adding 'moleculekit/share/pdb2pqr/residues/HLU.dat' 2024-04-19T11:48:14,439 adding 'moleculekit/share/pdb2pqr/residues/HLU.xml' 2024-04-19T11:48:14,440 adding 'moleculekit/share/pdb2pqr/residues/HLX.dat' 2024-04-19T11:48:14,442 adding 'moleculekit/share/pdb2pqr/residues/HLX.xml' 2024-04-19T11:48:14,443 adding 'moleculekit/share/pdb2pqr/residues/HOX.dat' 2024-04-19T11:48:14,444 adding 'moleculekit/share/pdb2pqr/residues/HOX.xml' 2024-04-19T11:48:14,445 adding 'moleculekit/share/pdb2pqr/residues/HPE.dat' 2024-04-19T11:48:14,446 adding 'moleculekit/share/pdb2pqr/residues/HPE.xml' 2024-04-19T11:48:14,448 adding 'moleculekit/share/pdb2pqr/residues/HQA.dat' 2024-04-19T11:48:14,449 adding 'moleculekit/share/pdb2pqr/residues/HQA.xml' 2024-04-19T11:48:14,450 adding 'moleculekit/share/pdb2pqr/residues/HTR.dat' 2024-04-19T11:48:14,451 adding 'moleculekit/share/pdb2pqr/residues/HTR.xml' 2024-04-19T11:48:14,452 adding 'moleculekit/share/pdb2pqr/residues/HYP.dat' 2024-04-19T11:48:14,454 adding 'moleculekit/share/pdb2pqr/residues/HYP.xml' 2024-04-19T11:48:14,455 adding 'moleculekit/share/pdb2pqr/residues/I2M.dat' 2024-04-19T11:48:14,456 adding 'moleculekit/share/pdb2pqr/residues/I2M.xml' 2024-04-19T11:48:14,457 adding 'moleculekit/share/pdb2pqr/residues/IGL.dat' 2024-04-19T11:48:14,459 adding 'moleculekit/share/pdb2pqr/residues/IGL.xml' 2024-04-19T11:48:14,460 adding 'moleculekit/share/pdb2pqr/residues/IIL.dat' 2024-04-19T11:48:14,461 adding 'moleculekit/share/pdb2pqr/residues/IIL.xml' 2024-04-19T11:48:14,462 adding 'moleculekit/share/pdb2pqr/residues/IML.dat' 2024-04-19T11:48:14,464 adding 'moleculekit/share/pdb2pqr/residues/IML.xml' 2024-04-19T11:48:14,465 adding 'moleculekit/share/pdb2pqr/residues/KYN.dat' 2024-04-19T11:48:14,466 adding 'moleculekit/share/pdb2pqr/residues/KYN.xml' 2024-04-19T11:48:14,467 adding 'moleculekit/share/pdb2pqr/residues/LME.dat' 2024-04-19T11:48:14,469 adding 'moleculekit/share/pdb2pqr/residues/LME.xml' 2024-04-19T11:48:14,470 adding 'moleculekit/share/pdb2pqr/residues/LMQ.dat' 2024-04-19T11:48:14,471 adding 'moleculekit/share/pdb2pqr/residues/LMQ.xml' 2024-04-19T11:48:14,472 adding 'moleculekit/share/pdb2pqr/residues/LYZ.dat' 2024-04-19T11:48:14,474 adding 'moleculekit/share/pdb2pqr/residues/LYZ.xml' 2024-04-19T11:48:14,475 adding 'moleculekit/share/pdb2pqr/residues/M3L.dat' 2024-04-19T11:48:14,476 adding 'moleculekit/share/pdb2pqr/residues/M3L.xml' 2024-04-19T11:48:14,478 adding 'moleculekit/share/pdb2pqr/residues/ME0.dat' 2024-04-19T11:48:14,479 adding 'moleculekit/share/pdb2pqr/residues/ME0.xml' 2024-04-19T11:48:14,480 adding 'moleculekit/share/pdb2pqr/residues/MEA.dat' 2024-04-19T11:48:14,481 adding 'moleculekit/share/pdb2pqr/residues/MEA.xml' 2024-04-19T11:48:14,482 adding 'moleculekit/share/pdb2pqr/residues/MEN.dat' 2024-04-19T11:48:14,484 adding 'moleculekit/share/pdb2pqr/residues/MEN.xml' 2024-04-19T11:48:14,485 adding 'moleculekit/share/pdb2pqr/residues/MEQ.dat' 2024-04-19T11:48:14,486 adding 'moleculekit/share/pdb2pqr/residues/MEQ.xml' 2024-04-19T11:48:14,487 adding 'moleculekit/share/pdb2pqr/residues/MLE.dat' 2024-04-19T11:48:14,488 adding 'moleculekit/share/pdb2pqr/residues/MLE.xml' 2024-04-19T11:48:14,489 adding 'moleculekit/share/pdb2pqr/residues/MLY.dat' 2024-04-19T11:48:14,491 adding 'moleculekit/share/pdb2pqr/residues/MLY.xml' 2024-04-19T11:48:14,492 adding 'moleculekit/share/pdb2pqr/residues/MLZ.dat' 2024-04-19T11:48:14,493 adding 'moleculekit/share/pdb2pqr/residues/MLZ.xml' 2024-04-19T11:48:14,494 adding 'moleculekit/share/pdb2pqr/residues/MME.dat' 2024-04-19T11:48:14,495 adding 'moleculekit/share/pdb2pqr/residues/MME.xml' 2024-04-19T11:48:14,496 adding 'moleculekit/share/pdb2pqr/residues/MMO.dat' 2024-04-19T11:48:14,497 adding 'moleculekit/share/pdb2pqr/residues/MMO.xml' 2024-04-19T11:48:14,499 adding 'moleculekit/share/pdb2pqr/residues/MVA.dat' 2024-04-19T11:48:14,500 adding 'moleculekit/share/pdb2pqr/residues/MVA.xml' 2024-04-19T11:48:14,501 adding 'moleculekit/share/pdb2pqr/residues/NAL.dat' 2024-04-19T11:48:14,502 adding 'moleculekit/share/pdb2pqr/residues/NAL.xml' 2024-04-19T11:48:14,503 adding 'moleculekit/share/pdb2pqr/residues/NCY.dat' 2024-04-19T11:48:14,505 adding 'moleculekit/share/pdb2pqr/residues/NCY.xml' 2024-04-19T11:48:14,506 adding 'moleculekit/share/pdb2pqr/residues/NLE.dat' 2024-04-19T11:48:14,507 adding 'moleculekit/share/pdb2pqr/residues/NLE.xml' 2024-04-19T11:48:14,508 adding 'moleculekit/share/pdb2pqr/residues/NVA.dat' 2024-04-19T11:48:14,509 adding 'moleculekit/share/pdb2pqr/residues/NVA.xml' 2024-04-19T11:48:14,511 adding 'moleculekit/share/pdb2pqr/residues/NZC.dat' 2024-04-19T11:48:14,512 adding 'moleculekit/share/pdb2pqr/residues/NZC.xml' 2024-04-19T11:48:14,513 adding 'moleculekit/share/pdb2pqr/residues/OCY.dat' 2024-04-19T11:48:14,514 adding 'moleculekit/share/pdb2pqr/residues/OCY.xml' 2024-04-19T11:48:14,515 adding 'moleculekit/share/pdb2pqr/residues/OMX.dat' 2024-04-19T11:48:14,517 adding 'moleculekit/share/pdb2pqr/residues/OMX.xml' 2024-04-19T11:48:14,518 adding 'moleculekit/share/pdb2pqr/residues/ONL.dat' 2024-04-19T11:48:14,519 adding 'moleculekit/share/pdb2pqr/residues/ONL.xml' 2024-04-19T11:48:14,520 adding 'moleculekit/share/pdb2pqr/residues/ORM.dat' 2024-04-19T11:48:14,521 adding 'moleculekit/share/pdb2pqr/residues/ORM.xml' 2024-04-19T11:48:14,523 adding 'moleculekit/share/pdb2pqr/residues/P1L.dat' 2024-04-19T11:48:14,524 adding 'moleculekit/share/pdb2pqr/residues/P1L.xml' 2024-04-19T11:48:14,525 adding 'moleculekit/share/pdb2pqr/residues/PCA.dat' 2024-04-19T11:48:14,526 adding 'moleculekit/share/pdb2pqr/residues/PCA.xml' 2024-04-19T11:48:14,528 adding 'moleculekit/share/pdb2pqr/residues/PRK.dat' 2024-04-19T11:48:14,529 adding 'moleculekit/share/pdb2pqr/residues/PRK.xml' 2024-04-19T11:48:14,530 adding 'moleculekit/share/pdb2pqr/residues/PTR.dat' 2024-04-19T11:48:14,531 adding 'moleculekit/share/pdb2pqr/residues/PTR.xml' 2024-04-19T11:48:14,533 adding 'moleculekit/share/pdb2pqr/residues/SEP.dat' 2024-04-19T11:48:14,534 adding 'moleculekit/share/pdb2pqr/residues/SEP.xml' 2024-04-19T11:48:14,535 adding 'moleculekit/share/pdb2pqr/residues/TPO.dat' 2024-04-19T11:48:14,536 adding 'moleculekit/share/pdb2pqr/residues/TPO.xml' 2024-04-19T11:48:14,537 adding 'moleculekit/share/pdb2pqr/residues/TRO.dat' 2024-04-19T11:48:14,539 adding 'moleculekit/share/pdb2pqr/residues/TRO.xml' 2024-04-19T11:48:14,540 adding 'moleculekit/share/pdb2pqr/residues/TY2.dat' 2024-04-19T11:48:14,542 adding 'moleculekit/share/pdb2pqr/residues/TY2.xml' 2024-04-19T11:48:14,543 adding 'moleculekit/share/pdb2pqr/residues/TYQ.dat' 2024-04-19T11:48:14,544 adding 'moleculekit/share/pdb2pqr/residues/TYQ.xml' 2024-04-19T11:48:14,545 adding 'moleculekit/share/pdb2pqr/residues/YCM.dat' 2024-04-19T11:48:14,546 adding 'moleculekit/share/pdb2pqr/residues/YCM.xml' 2024-04-19T11:48:14,548 adding 'moleculekit/share/pdb2pqr/residues/YNM.dat' 2024-04-19T11:48:14,549 adding 'moleculekit/share/pdb2pqr/residues/YNM.xml' 2024-04-19T11:48:14,551 adding 'moleculekit/smallmol/__init__.py' 2024-04-19T11:48:14,556 adding 'moleculekit/smallmol/smallmol.py' 2024-04-19T11:48:14,558 adding 'moleculekit/smallmol/smallmolcdp.py' 2024-04-19T11:48:14,560 adding 'moleculekit/smallmol/smallmollib.py' 2024-04-19T11:48:14,562 adding 'moleculekit/smallmol/test_smallmol.py' 2024-04-19T11:48:14,563 adding 'moleculekit/smallmol/test_smallmollib.py' 2024-04-19T11:48:14,565 adding 'moleculekit/smallmol/util.py' 2024-04-19T11:48:14,566 adding 'moleculekit/smallmol/tools/__init__.py' 2024-04-19T11:48:14,568 adding 'moleculekit/smallmol/tools/clustering.py' 2024-04-19T11:48:14,570 adding 'moleculekit/smallmol/tools/restrainedembed.py' 2024-04-19T11:48:14,571 adding 'moleculekit/smallmol/tools/test_tools.py' 2024-04-19T11:48:14,665 adding 'moleculekit/tmalign/tmalign_util.cpp' 2024-04-19T11:48:14,676 adding 'moleculekit/tmalign/tmalign_util.pyx' 2024-04-19T11:48:14,677 adding 'moleculekit/tmalign/tmalignlib.pxd' 2024-04-19T11:48:14,679 adding 'moleculekit/tmalign/include/TMAlign.h' 2024-04-19T11:48:14,696 adding 'moleculekit/tmalign/src/TMAlign.cpp' 2024-04-19T11:48:14,699 adding 'moleculekit/tools/__init__.py' 2024-04-19T11:48:14,701 adding 'moleculekit/tools/atomtyper.py' 2024-04-19T11:48:14,703 adding 'moleculekit/tools/autosegment.py' 2024-04-19T11:48:14,705 adding 'moleculekit/tools/crystalpacking.py' 2024-04-19T11:48:14,708 adding 'moleculekit/tools/detect.py' 2024-04-19T11:48:14,710 adding 'moleculekit/tools/docking.py' 2024-04-19T11:48:14,712 adding 'moleculekit/tools/graphalignment.py' 2024-04-19T11:48:14,714 adding 'moleculekit/tools/hhblitsprofile.py' 2024-04-19T11:48:14,715 adding 'moleculekit/tools/modelling.py' 2024-04-19T11:48:14,717 adding 'moleculekit/tools/moleculechecks.py' 2024-04-19T11:48:14,723 adding 'moleculekit/tools/preparation.py' 2024-04-19T11:48:14,725 adding 'moleculekit/tools/preparation_customres.py' 2024-04-19T11:48:14,727 adding 'moleculekit/tools/sequencestructuralalignment.py' 2024-04-19T11:48:14,730 adding 'moleculekit/tools/voxeldescriptors.py' 2024-04-19T11:48:14,732 adding 'moleculekit/tools/obabel_tools/__init__.py' 2024-04-19T11:48:14,733 adding 'moleculekit/tools/obabel_tools/obabel_cli.py' 2024-04-19T11:48:14,824 adding 'moleculekit/wrapping/wrapping.cpp' 2024-04-19T11:48:14,833 adding 'moleculekit/wrapping/wrapping.pyx' 2024-04-19T11:48:14,835 adding 'moleculekit-1.8.31.dist-info/LICENSE' 2024-04-19T11:48:14,837 adding 'moleculekit-1.8.31.dist-info/METADATA' 2024-04-19T11:48:14,838 adding 'moleculekit-1.8.31.dist-info/WHEEL' 2024-04-19T11:48:14,839 adding 'moleculekit-1.8.31.dist-info/top_level.txt' 2024-04-19T11:48:14,844 adding 'moleculekit-1.8.31.dist-info/RECORD' 2024-04-19T11:48:14,996 removing build/bdist.linux-armv7l/wheel 2024-04-19T11:48:15,303 Building wheel for moleculekit (pyproject.toml): finished with status 'done' 2024-04-19T11:48:15,647 Created wheel for moleculekit: filename=moleculekit-1.8.31-cp311-cp311-linux_armv7l.whl size=15274257 sha256=218f8197ef61b4d204fdf063e6c7161b0c1cada6b9072a80ed32467b83651997 2024-04-19T11:48:15,648 Stored in directory: /tmp/pip-ephem-wheel-cache-lb1amqou/wheels/0f/ea/2a/fb0ecc60be609e69237a64cfaf40dbb5de40f3b61aa96f28ca 2024-04-19T11:48:15,674 Successfully built moleculekit 2024-04-19T11:48:16,033 Removed build tracker: '/tmp/pip-build-tracker-d5655o44'