2024-05-10T11:53:29,203 Created temporary directory: /tmp/pip-build-tracker-mlpo9wa5 2024-05-10T11:53:29,204 Initialized build tracking at /tmp/pip-build-tracker-mlpo9wa5 2024-05-10T11:53:29,204 Created build tracker: /tmp/pip-build-tracker-mlpo9wa5 2024-05-10T11:53:29,205 Entered build tracker: /tmp/pip-build-tracker-mlpo9wa5 2024-05-10T11:53:29,205 Created temporary directory: /tmp/pip-wheel-p0xvlmay 2024-05-10T11:53:29,209 Created temporary directory: /tmp/pip-ephem-wheel-cache-zmmv29i7 2024-05-10T11:53:29,235 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-05-10T11:53:29,239 2 location(s) to search for versions of moleculekit: 2024-05-10T11:53:29,239 * https://pypi.org/simple/moleculekit/ 2024-05-10T11:53:29,239 * https://www.piwheels.org/simple/moleculekit/ 2024-05-10T11:53:29,239 Fetching project page and analyzing links: https://pypi.org/simple/moleculekit/ 2024-05-10T11:53:29,240 Getting page https://pypi.org/simple/moleculekit/ 2024-05-10T11:53:29,242 Found index url https://pypi.org/simple/ 2024-05-10T11:53:29,299 Fetched page https://pypi.org/simple/moleculekit/ as application/vnd.pypi.simple.v1+json 2024-05-10T11:53:29,342 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/) 2024-05-10T11:53:29,342 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 2024-05-10T11:53:29,343 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/) 2024-05-10T11:53:29,343 Found link 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(from https://www.piwheels.org/simple/moleculekit/) 2024-05-10T11:53:29,694 Skipping link: No binaries permitted for moleculekit: https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.8-py3-none-any.whl#sha256=716d25ae18a4a9a3c8cfb1f0b0399f72463490e4f85a66631f3e77c0ddc427e3 (from https://www.piwheels.org/simple/moleculekit/) 2024-05-10T11:53:29,694 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/) 2024-05-10T11:53:29,694 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/) 2024-05-10T11:53:29,694 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/) 2024-05-10T11:53:29,695 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/) 2024-05-10T11:53:29,695 Skipping link: not a file: https://www.piwheels.org/simple/moleculekit/ 2024-05-10T11:53:29,695 Skipping link: not a file: https://pypi.org/simple/moleculekit/ 2024-05-10T11:53:29,740 Given no hashes to check 1 links for project 'moleculekit': discarding no candidates 2024-05-10T11:53:29,758 Collecting moleculekit==1.8.32 2024-05-10T11:53:29,760 Created temporary directory: /tmp/pip-unpack-r8ie317v 2024-05-10T11:53:29,803 Downloading moleculekit-1.8.32.tar.gz (6.8 MB) 2024-05-10T11:53:32,039 Added moleculekit==1.8.32 from https://files.pythonhosted.org/packages/5a/df/44bc133f3cbda05e621a72b9fef30ecaa96bc88bd5f47136a89b22d82b30/moleculekit-1.8.32.tar.gz to build tracker '/tmp/pip-build-tracker-mlpo9wa5' 2024-05-10T11:53:32,048 Created temporary directory: /tmp/pip-build-env-ffgqyra7 2024-05-10T11:53:32,058 Installing build dependencies: started 2024-05-10T11:53:32,059 Running command pip subprocess to install build dependencies 2024-05-10T11:53:33,213 Using pip 24.0 from /usr/local/lib/python3.9/dist-packages/pip (python 3.9) 2024-05-10T11:53:33,727 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-05-10T11:53:35,289 Collecting setuptools 2024-05-10T11:53:35,310 Using cached https://www.piwheels.org/simple/setuptools/setuptools-69.5.1-py3-none-any.whl (894 kB) 2024-05-10T11:53:36,367 Collecting numpy>=1.18.5 2024-05-10T11:53:36,397 Using cached https://www.piwheels.org/simple/numpy/numpy-1.26.4-cp39-cp39-linux_armv7l.whl (5.6 MB) 2024-05-10T11:53:38,003 Collecting Cython>=0.29.21 2024-05-10T11:53:38,032 Using cached https://www.piwheels.org/simple/cython/Cython-3.0.10-cp39-cp39-linux_armv7l.whl (10.7 MB) 2024-05-10T11:53:38,421 Collecting toml 2024-05-10T11:53:38,441 Downloading https://www.piwheels.org/simple/toml/toml-0.10.2-py2.py3-none-any.whl (16 kB) 2024-05-10T11:53:38,563 Collecting versioneer==0.28 (from versioneer[toml]==0.28) 2024-05-10T11:53:38,583 Using cached https://www.piwheels.org/simple/versioneer/versioneer-0.28-py3-none-any.whl (45 kB) 2024-05-10T11:53:38,715 Collecting tomli (from versioneer[toml]==0.28) 2024-05-10T11:53:38,735 Using cached https://www.piwheels.org/simple/tomli/tomli-2.0.1-py3-none-any.whl (12 kB) 2024-05-10T11:53:40,600 Installing collected packages: versioneer, tomli, toml, setuptools, numpy, Cython 2024-05-10T11:53:40,638 Creating /tmp/pip-build-env-ffgqyra7/overlay/bin 2024-05-10T11:53:40,640 changing mode of /tmp/pip-build-env-ffgqyra7/overlay/bin/versioneer to 755 2024-05-10T11:53:53,915 changing mode of /tmp/pip-build-env-ffgqyra7/overlay/bin/f2py to 755 2024-05-10T11:53:57,378 changing mode of /tmp/pip-build-env-ffgqyra7/overlay/bin/cygdb to 755 2024-05-10T11:53:57,381 changing mode of /tmp/pip-build-env-ffgqyra7/overlay/bin/cython to 755 2024-05-10T11:53:57,384 changing mode of /tmp/pip-build-env-ffgqyra7/overlay/bin/cythonize to 755 2024-05-10T11:53:57,409 Successfully installed Cython-3.0.10 numpy-1.26.4 setuptools-69.5.1 toml-0.10.2 tomli-2.0.1 versioneer-0.28 2024-05-10T11:53:58,082 Installing build dependencies: finished with status 'done' 2024-05-10T11:53:58,087 Getting requirements to build wheel: started 2024-05-10T11:53:58,088 Running command Getting requirements to build wheel 2024-05-10T11:54:36,657 warning: moleculekit/wrapping/wrapping.pyx:47:4: Unreachable code 2024-05-10T11:54:45,638 Compiling moleculekit/interactions/hbonds/hbonds.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,638 Compiling moleculekit/interactions/pipi/pipi.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,638 Compiling moleculekit/interactions/cationpi/cationpi.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,638 Compiling moleculekit/interactions/sigmahole/sigmahole.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,639 Compiling moleculekit/wrapping/wrapping.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,639 Compiling moleculekit/bondguesser_utils/bondguesser_utils.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,639 Compiling moleculekit/atomselect_utils/atomselect_utils.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,639 Compiling moleculekit/distance_utils/distance_utils.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,639 Compiling moleculekit/occupancy_utils/occupancy_utils.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,639 Compiling moleculekit/cython_utils/cython_utils.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,639 Compiling moleculekit/fileformats/xtc/xtc.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-05-10T11:54:45,639 Compiling moleculekit/fileformats/xtc/trr.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-05-10T11:54:45,640 Compiling moleculekit/fileformats/dcd/dcd.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-05-10T11:54:45,640 Compiling moleculekit/fileformats/binpos/binpos.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-05-10T11:54:45,640 Compiling moleculekit/tmalign/tmalign_util.pyx because it depends on /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-05-10T11:54:45,640 [ 1/15] Cythonizing moleculekit/atomselect_utils/atomselect_utils.pyx 2024-05-10T11:54:45,640 [ 2/15] Cythonizing moleculekit/bondguesser_utils/bondguesser_utils.pyx 2024-05-10T11:54:45,640 [ 3/15] Cythonizing moleculekit/cython_utils/cython_utils.pyx 2024-05-10T11:54:45,640 [ 4/15] Cythonizing moleculekit/distance_utils/distance_utils.pyx 2024-05-10T11:54:45,640 [ 5/15] Cythonizing moleculekit/fileformats/dcd/dcd.pyx 2024-05-10T11:54:45,640 [ 6/15] Cythonizing moleculekit/interactions/cationpi/cationpi.pyx 2024-05-10T11:54:45,641 [ 7/15] Cythonizing moleculekit/interactions/hbonds/hbonds.pyx 2024-05-10T11:54:45,641 [ 8/15] Cythonizing moleculekit/interactions/pipi/pipi.pyx 2024-05-10T11:54:45,641 [ 9/15] Cythonizing moleculekit/interactions/sigmahole/sigmahole.pyx 2024-05-10T11:54:45,641 [10/15] Cythonizing moleculekit/occupancy_utils/occupancy_utils.pyx 2024-05-10T11:54:45,641 [11/15] Cythonizing moleculekit/tmalign/tmalign_util.pyx 2024-05-10T11:54:45,641 [12/15] Cythonizing moleculekit/wrapping/wrapping.pyx 2024-05-10T11:54:45,641 [13/15] Cythonizing moleculekit/fileformats/binpos/binpos.pyx 2024-05-10T11:54:45,641 [14/15] Cythonizing moleculekit/fileformats/xtc/trr.pyx 2024-05-10T11:54:45,641 [15/15] Cythonizing moleculekit/fileformats/xtc/xtc.pyx 2024-05-10T11:54:45,941 running egg_info 2024-05-10T11:54:45,948 writing moleculekit.egg-info/PKG-INFO 2024-05-10T11:54:45,951 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-05-10T11:54:45,954 writing requirements to moleculekit.egg-info/requires.txt 2024-05-10T11:54:45,956 writing top-level names to moleculekit.egg-info/top_level.txt 2024-05-10T11:54:45,987 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:45,987 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:45,988 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:45,988 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:45,988 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:45,989 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:45,989 dependency 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manifest: the path must be relative 2024-05-10T11:54:46,012 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:46,023 reading manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-05-10T11:54:46,057 reading manifest template 'MANIFEST.in' 2024-05-10T11:54:46,320 no previously-included directories found matching 'moleculekit/test-data' 2024-05-10T11:54:46,321 no previously-included directories found matching 'moleculekit/tests' 2024-05-10T11:54:46,322 no previously-included directories found matching 'package' 2024-05-10T11:54:46,322 adding license file 'LICENSE' 2024-05-10T11:54:46,341 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-05-10T11:54:47,720 Getting requirements to build wheel: finished with status 'done' 2024-05-10T11:54:47,735 Installing backend dependencies: started 2024-05-10T11:54:47,736 Running command pip subprocess to install backend dependencies 2024-05-10T11:54:48,976 Using pip 24.0 from /usr/local/lib/python3.9/dist-packages/pip (python 3.9) 2024-05-10T11:54:49,529 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-05-10T11:54:49,924 Collecting wheel 2024-05-10T11:54:49,943 Using cached https://www.piwheels.org/simple/wheel/wheel-0.43.0-py3-none-any.whl (65 kB) 2024-05-10T11:54:51,399 Installing collected packages: wheel 2024-05-10T11:54:51,623 Creating /tmp/pip-build-env-ffgqyra7/normal/bin 2024-05-10T11:54:51,625 changing mode of /tmp/pip-build-env-ffgqyra7/normal/bin/wheel to 755 2024-05-10T11:54:51,637 Successfully installed wheel-0.43.0 2024-05-10T11:54:52,021 Installing backend dependencies: finished with status 'done' 2024-05-10T11:54:52,023 Created temporary directory: /tmp/pip-modern-metadata-l4b1wct9 2024-05-10T11:54:52,026 Preparing metadata (pyproject.toml): started 2024-05-10T11:54:52,027 Running command Preparing metadata (pyproject.toml) 2024-05-10T11:54:54,531 running dist_info 2024-05-10T11:54:54,533 creating /tmp/pip-modern-metadata-l4b1wct9/moleculekit.egg-info 2024-05-10T11:54:54,539 writing /tmp/pip-modern-metadata-l4b1wct9/moleculekit.egg-info/PKG-INFO 2024-05-10T11:54:54,543 writing dependency_links to /tmp/pip-modern-metadata-l4b1wct9/moleculekit.egg-info/dependency_links.txt 2024-05-10T11:54:54,545 writing requirements to /tmp/pip-modern-metadata-l4b1wct9/moleculekit.egg-info/requires.txt 2024-05-10T11:54:54,546 writing top-level names to /tmp/pip-modern-metadata-l4b1wct9/moleculekit.egg-info/top_level.txt 2024-05-10T11:54:54,547 writing manifest file '/tmp/pip-modern-metadata-l4b1wct9/moleculekit.egg-info/SOURCES.txt' 2024-05-10T11:54:54,578 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,579 dependency 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manifest: the path must be relative 2024-05-10T11:54:54,582 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,582 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,582 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,582 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,582 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,582 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,582 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,583 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,583 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,583 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,583 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,583 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,583 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,583 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,583 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,584 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,584 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,584 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,584 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,584 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,584 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,584 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,584 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,585 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,585 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,585 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,585 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,585 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,585 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,585 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,585 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,586 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,586 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,586 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,586 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,586 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,588 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,588 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,588 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,588 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,588 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,589 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,589 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,589 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,589 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,589 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,590 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,590 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,590 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,591 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,591 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:54,599 reading manifest file '/tmp/pip-modern-metadata-l4b1wct9/moleculekit.egg-info/SOURCES.txt' 2024-05-10T11:54:54,601 reading manifest template 'MANIFEST.in' 2024-05-10T11:54:54,874 no previously-included directories found matching 'moleculekit/test-data' 2024-05-10T11:54:54,875 no previously-included directories found matching 'moleculekit/tests' 2024-05-10T11:54:54,876 no previously-included directories found matching 'package' 2024-05-10T11:54:54,876 adding license file 'LICENSE' 2024-05-10T11:54:54,889 writing manifest file '/tmp/pip-modern-metadata-l4b1wct9/moleculekit.egg-info/SOURCES.txt' 2024-05-10T11:54:54,898 creating '/tmp/pip-modern-metadata-l4b1wct9/moleculekit-1.8.32.dist-info' 2024-05-10T11:54:55,102 Preparing metadata (pyproject.toml): finished with status 'done' 2024-05-10T11:54:55,108 Source in /tmp/pip-wheel-p0xvlmay/moleculekit_ca577d5a4c3041ce86a2c14fc965fad5 has version 1.8.32, which satisfies requirement moleculekit==1.8.32 from https://files.pythonhosted.org/packages/5a/df/44bc133f3cbda05e621a72b9fef30ecaa96bc88bd5f47136a89b22d82b30/moleculekit-1.8.32.tar.gz 2024-05-10T11:54:55,109 Removed moleculekit==1.8.32 from https://files.pythonhosted.org/packages/5a/df/44bc133f3cbda05e621a72b9fef30ecaa96bc88bd5f47136a89b22d82b30/moleculekit-1.8.32.tar.gz from build tracker '/tmp/pip-build-tracker-mlpo9wa5' 2024-05-10T11:54:55,115 Created temporary directory: /tmp/pip-unpack-m2n4515i 2024-05-10T11:54:55,116 Created temporary directory: /tmp/pip-unpack-5gyg9y29 2024-05-10T11:54:55,124 Building wheels for collected packages: moleculekit 2024-05-10T11:54:55,129 Created temporary directory: /tmp/pip-wheel-cngdb13a 2024-05-10T11:54:55,129 Destination directory: /tmp/pip-wheel-cngdb13a 2024-05-10T11:54:55,131 Building wheel for moleculekit (pyproject.toml): started 2024-05-10T11:54:55,132 Running command Building wheel for moleculekit (pyproject.toml) 2024-05-10T11:54:57,486 running bdist_wheel 2024-05-10T11:54:57,503 running build 2024-05-10T11:54:57,503 running build_py 2024-05-10T11:54:57,511 creating build 2024-05-10T11:54:57,512 creating build/lib.linux-armv7l-cpython-39 2024-05-10T11:54:57,513 creating build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,514 copying moleculekit/viewer.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,516 copying moleculekit/align.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,518 copying moleculekit/readers.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,522 copying moleculekit/distance.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,524 copying moleculekit/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,527 copying moleculekit/config.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,529 copying moleculekit/vmdviewer.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,531 copying moleculekit/molecule.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,537 copying moleculekit/dihedral.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,539 copying moleculekit/vmdgraphics.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,541 copying moleculekit/home.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,543 copying moleculekit/rdkitintegration.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,545 copying moleculekit/bondguesser.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,547 copying moleculekit/version.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,549 copying moleculekit/rcsb.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,550 copying moleculekit/pymolgraphics.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,552 copying moleculekit/writers.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,556 copying moleculekit/_version.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,558 copying moleculekit/opm.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,560 copying moleculekit/periodictable.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,562 copying moleculekit/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:57,565 creating build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-05-10T11:54:57,566 copying moleculekit/ply/yacc.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-05-10T11:54:57,571 copying moleculekit/ply/lex.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-05-10T11:54:57,574 copying moleculekit/ply/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-05-10T11:54:57,577 creating build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-05-10T11:54:57,578 copying moleculekit/smallmol/smallmollib.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-05-10T11:54:57,580 copying moleculekit/smallmol/smallmol.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-05-10T11:54:57,583 copying moleculekit/smallmol/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-05-10T11:54:57,586 copying moleculekit/smallmol/smallmolcdp.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-05-10T11:54:57,588 copying moleculekit/smallmol/test_smallmol.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-05-10T11:54:57,590 copying moleculekit/smallmol/test_smallmollib.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-05-10T11:54:57,593 copying moleculekit/smallmol/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-05-10T11:54:57,595 creating build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-05-10T11:54:57,596 copying moleculekit/atomselect/atomselect.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-05-10T11:54:57,598 copying moleculekit/atomselect/languageparser.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-05-10T11:54:57,600 copying moleculekit/atomselect/analyze.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-05-10T11:54:57,602 copying moleculekit/atomselect/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-05-10T11:54:57,605 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-05-10T11:54:57,605 copying moleculekit/fileformats/utils.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-05-10T11:54:57,608 copying moleculekit/fileformats/netcdf.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-05-10T11:54:57,611 copying moleculekit/fileformats/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-05-10T11:54:57,613 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-05-10T11:54:57,614 copying moleculekit/interactions/interactions.py -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-05-10T11:54:57,617 copying moleculekit/interactions/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-05-10T11:54:57,620 creating build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,620 copying moleculekit/tools/voxeldescriptors.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,623 copying moleculekit/tools/crystalpacking.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,625 copying moleculekit/tools/hhblitsprofile.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,627 copying moleculekit/tools/preparation_customres.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,629 copying moleculekit/tools/detect.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,632 copying moleculekit/tools/graphalignment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,634 copying moleculekit/tools/modelling.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,636 copying moleculekit/tools/moleculechecks.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,639 copying moleculekit/tools/preparation.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,642 copying moleculekit/tools/atomtyper.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,644 copying moleculekit/tools/docking.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,646 copying moleculekit/tools/sequencestructuralalignment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,649 copying moleculekit/tools/autosegment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,651 copying moleculekit/tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-05-10T11:54:57,653 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx 2024-05-10T11:54:57,654 copying moleculekit/pdbx/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx 2024-05-10T11:54:57,657 creating build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,657 copying moleculekit/projections/metricsasa.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,660 copying moleculekit/projections/metricdihedral.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,663 copying moleculekit/projections/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,665 copying moleculekit/projections/metricfluctuation.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,667 copying moleculekit/projections/projection.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,669 copying moleculekit/projections/metricdistance.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,672 copying moleculekit/projections/metrictmscore.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,675 copying moleculekit/projections/metricshell.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,677 copying moleculekit/projections/metricgyration.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,679 copying moleculekit/projections/metricrmsd.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,681 copying moleculekit/projections/metricplumed2.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,684 copying moleculekit/projections/metricsecondarystructure.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,686 copying moleculekit/projections/metricsphericalcoordinate.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,688 copying moleculekit/projections/metriccoordinate.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,691 copying moleculekit/projections/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-05-10T11:54:57,693 creating build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-05-10T11:54:57,694 copying moleculekit/smallmol/tools/restrainedembed.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-05-10T11:54:57,696 copying moleculekit/smallmol/tools/clustering.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-05-10T11:54:57,698 copying moleculekit/smallmol/tools/test_tools.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-05-10T11:54:57,700 copying moleculekit/smallmol/tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-05-10T11:54:57,703 creating build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-05-10T11:54:57,703 copying moleculekit/tools/obabel_tools/obabel_cli.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-05-10T11:54:57,706 copying moleculekit/tools/obabel_tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-05-10T11:54:57,708 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-05-10T11:54:57,709 copying moleculekit/pdbx/tests/PdbxWriterTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-05-10T11:54:57,711 copying moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-05-10T11:54:57,713 copying moleculekit/pdbx/tests/PdbxReaderTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-05-10T11:54:57,715 copying moleculekit/pdbx/tests/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-05-10T11:54:57,717 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-05-10T11:54:57,718 copying moleculekit/pdbx/writer/PdbxWriter.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-05-10T11:54:57,721 copying moleculekit/pdbx/writer/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-05-10T11:54:57,723 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-05-10T11:54:57,723 copying moleculekit/pdbx/reader/PdbxContainers.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-05-10T11:54:57,726 copying moleculekit/pdbx/reader/PdbxReader.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-05-10T11:54:57,729 copying moleculekit/pdbx/reader/PdbxParser.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-05-10T11:54:57,731 copying moleculekit/pdbx/reader/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-05-10T11:54:57,733 running egg_info 2024-05-10T11:54:57,738 writing moleculekit.egg-info/PKG-INFO 2024-05-10T11:54:57,741 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-05-10T11:54:57,743 writing requirements to moleculekit.egg-info/requires.txt 2024-05-10T11:54:57,744 writing top-level names to moleculekit.egg-info/top_level.txt 2024-05-10T11:54:57,763 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,763 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,763 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,763 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,763 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,764 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,764 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,764 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,764 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,764 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,764 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,764 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,765 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,765 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,765 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,765 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,765 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,765 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,765 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,765 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,766 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,766 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,766 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,766 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,766 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,766 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,766 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,767 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,767 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,767 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,767 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,767 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,767 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,767 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,768 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,768 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,768 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,768 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,768 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,768 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,768 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,768 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,768 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,769 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,769 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,769 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,769 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,769 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,769 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,769 dependency 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manifest: the path must be relative 2024-05-10T11:54:57,770 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,770 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,770 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,770 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,771 dependency 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manifest: the path must be relative 2024-05-10T11:54:57,775 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,775 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,776 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,776 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,776 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,776 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,776 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,777 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,777 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayscalars.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,777 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,778 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,778 dependency /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ufuncobject.h won't be automatically included in the manifest: the path must be relative 2024-05-10T11:54:57,784 reading manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-05-10T11:54:57,794 reading manifest template 'MANIFEST.in' 2024-05-10T11:54:58,051 no previously-included directories found matching 'moleculekit/test-data' 2024-05-10T11:54:58,052 no previously-included directories found matching 'moleculekit/tests' 2024-05-10T11:54:58,053 no previously-included directories found matching 'package' 2024-05-10T11:54:58,054 adding license file 'LICENSE' 2024-05-10T11:54:58,072 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-05-10T11:54:58,083 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.atomselect_utils' is absent from the `packages` configuration. 2024-05-10T11:54:58,083 !! 2024-05-10T11:54:58,083 ******************************************************************************** 2024-05-10T11:54:58,083 ############################ 2024-05-10T11:54:58,084 # Package would be ignored # 2024-05-10T11:54:58,084 ############################ 2024-05-10T11:54:58,084 Python recognizes 'moleculekit.atomselect_utils' as an importable package[^1], 2024-05-10T11:54:58,084 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,084 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,084 package, please make sure that 'moleculekit.atomselect_utils' is explicitly added 2024-05-10T11:54:58,084 to the `packages` configuration field. 2024-05-10T11:54:58,085 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,085 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,085 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,085 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,085 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,086 If you don't want 'moleculekit.atomselect_utils' to be distributed and are 2024-05-10T11:54:58,086 already explicitly excluding 'moleculekit.atomselect_utils' via 2024-05-10T11:54:58,086 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,086 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,086 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,086 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,086 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,087 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,087 even if it does not contain any `.py` files. 2024-05-10T11:54:58,087 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,087 directory, all directories are treated like packages. 2024-05-10T11:54:58,087 ******************************************************************************** 2024-05-10T11:54:58,088 !! 2024-05-10T11:54:58,088 check.warn(importable) 2024-05-10T11:54:58,088 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.bondguesser_utils' is absent from the `packages` configuration. 2024-05-10T11:54:58,088 !! 2024-05-10T11:54:58,088 ******************************************************************************** 2024-05-10T11:54:58,088 ############################ 2024-05-10T11:54:58,088 # Package would be ignored # 2024-05-10T11:54:58,089 ############################ 2024-05-10T11:54:58,089 Python recognizes 'moleculekit.bondguesser_utils' as an importable package[^1], 2024-05-10T11:54:58,089 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,089 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,089 package, please make sure that 'moleculekit.bondguesser_utils' is explicitly added 2024-05-10T11:54:58,089 to the `packages` configuration field. 2024-05-10T11:54:58,089 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,090 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,090 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,090 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,090 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,090 If you don't want 'moleculekit.bondguesser_utils' to be distributed and are 2024-05-10T11:54:58,090 already explicitly excluding 'moleculekit.bondguesser_utils' via 2024-05-10T11:54:58,091 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,091 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,091 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,091 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,091 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,092 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,092 even if it does not contain any `.py` files. 2024-05-10T11:54:58,092 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,092 directory, all directories are treated like packages. 2024-05-10T11:54:58,092 ******************************************************************************** 2024-05-10T11:54:58,092 !! 2024-05-10T11:54:58,092 check.warn(importable) 2024-05-10T11:54:58,093 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.cython_utils' is absent from the `packages` configuration. 2024-05-10T11:54:58,093 !! 2024-05-10T11:54:58,093 ******************************************************************************** 2024-05-10T11:54:58,093 ############################ 2024-05-10T11:54:58,093 # Package would be ignored # 2024-05-10T11:54:58,093 ############################ 2024-05-10T11:54:58,093 Python recognizes 'moleculekit.cython_utils' as an importable package[^1], 2024-05-10T11:54:58,093 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,094 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,094 package, please make sure that 'moleculekit.cython_utils' is explicitly added 2024-05-10T11:54:58,094 to the `packages` configuration field. 2024-05-10T11:54:58,094 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,094 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,094 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,095 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,095 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,095 If you don't want 'moleculekit.cython_utils' to be distributed and are 2024-05-10T11:54:58,095 already explicitly excluding 'moleculekit.cython_utils' via 2024-05-10T11:54:58,095 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,095 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,095 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,096 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,096 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,096 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,096 even if it does not contain any `.py` files. 2024-05-10T11:54:58,096 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,096 directory, all directories are treated like packages. 2024-05-10T11:54:58,097 ******************************************************************************** 2024-05-10T11:54:58,097 !! 2024-05-10T11:54:58,097 check.warn(importable) 2024-05-10T11:54:58,097 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.distance_utils' is absent from the `packages` configuration. 2024-05-10T11:54:58,097 !! 2024-05-10T11:54:58,097 ******************************************************************************** 2024-05-10T11:54:58,097 ############################ 2024-05-10T11:54:58,097 # Package would be ignored # 2024-05-10T11:54:58,098 ############################ 2024-05-10T11:54:58,098 Python recognizes 'moleculekit.distance_utils' as an importable package[^1], 2024-05-10T11:54:58,098 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,098 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,098 package, please make sure that 'moleculekit.distance_utils' is explicitly added 2024-05-10T11:54:58,098 to the `packages` configuration field. 2024-05-10T11:54:58,098 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,099 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,099 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,099 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,099 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,099 If you don't want 'moleculekit.distance_utils' to be distributed and are 2024-05-10T11:54:58,099 already explicitly excluding 'moleculekit.distance_utils' via 2024-05-10T11:54:58,099 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,100 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,100 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,100 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,100 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,100 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,101 even if it does not contain any `.py` files. 2024-05-10T11:54:58,101 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,101 directory, all directories are treated like packages. 2024-05-10T11:54:58,101 ******************************************************************************** 2024-05-10T11:54:58,101 !! 2024-05-10T11:54:58,101 check.warn(importable) 2024-05-10T11:54:58,101 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos' is absent from the `packages` configuration. 2024-05-10T11:54:58,101 !! 2024-05-10T11:54:58,102 ******************************************************************************** 2024-05-10T11:54:58,102 ############################ 2024-05-10T11:54:58,102 # Package would be ignored # 2024-05-10T11:54:58,102 ############################ 2024-05-10T11:54:58,102 Python recognizes 'moleculekit.fileformats.binpos' as an importable package[^1], 2024-05-10T11:54:58,102 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,102 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,102 package, please make sure that 'moleculekit.fileformats.binpos' is explicitly added 2024-05-10T11:54:58,102 to the `packages` configuration field. 2024-05-10T11:54:58,103 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,103 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,103 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,103 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,103 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,104 If you don't want 'moleculekit.fileformats.binpos' to be distributed and are 2024-05-10T11:54:58,104 already explicitly excluding 'moleculekit.fileformats.binpos' via 2024-05-10T11:54:58,104 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,104 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,104 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,104 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,104 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,105 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,105 even if it does not contain any `.py` files. 2024-05-10T11:54:58,105 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,105 directory, all directories are treated like packages. 2024-05-10T11:54:58,105 ******************************************************************************** 2024-05-10T11:54:58,105 !! 2024-05-10T11:54:58,106 check.warn(importable) 2024-05-10T11:54:58,106 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos.include' is absent from the `packages` configuration. 2024-05-10T11:54:58,106 !! 2024-05-10T11:54:58,106 ******************************************************************************** 2024-05-10T11:54:58,106 ############################ 2024-05-10T11:54:58,106 # Package would be ignored # 2024-05-10T11:54:58,106 ############################ 2024-05-10T11:54:58,106 Python recognizes 'moleculekit.fileformats.binpos.include' as an importable package[^1], 2024-05-10T11:54:58,107 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,107 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,107 package, please make sure that 'moleculekit.fileformats.binpos.include' is explicitly added 2024-05-10T11:54:58,107 to the `packages` configuration field. 2024-05-10T11:54:58,107 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,107 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,107 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,108 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,108 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,108 If you don't want 'moleculekit.fileformats.binpos.include' to be distributed and are 2024-05-10T11:54:58,108 already explicitly excluding 'moleculekit.fileformats.binpos.include' via 2024-05-10T11:54:58,108 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,108 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,109 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,109 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,109 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,109 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,109 even if it does not contain any `.py` files. 2024-05-10T11:54:58,109 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,110 directory, all directories are treated like packages. 2024-05-10T11:54:58,110 ******************************************************************************** 2024-05-10T11:54:58,110 !! 2024-05-10T11:54:58,110 check.warn(importable) 2024-05-10T11:54:58,110 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.binpos.src' is absent from the `packages` configuration. 2024-05-10T11:54:58,110 !! 2024-05-10T11:54:58,110 ******************************************************************************** 2024-05-10T11:54:58,111 ############################ 2024-05-10T11:54:58,111 # Package would be ignored # 2024-05-10T11:54:58,111 ############################ 2024-05-10T11:54:58,111 Python recognizes 'moleculekit.fileformats.binpos.src' as an importable package[^1], 2024-05-10T11:54:58,111 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,111 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,111 package, please make sure that 'moleculekit.fileformats.binpos.src' is explicitly added 2024-05-10T11:54:58,111 to the `packages` configuration field. 2024-05-10T11:54:58,112 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,112 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,112 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,112 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,112 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,113 If you don't want 'moleculekit.fileformats.binpos.src' to be distributed and are 2024-05-10T11:54:58,113 already explicitly excluding 'moleculekit.fileformats.binpos.src' via 2024-05-10T11:54:58,113 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,113 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,113 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,113 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,113 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,114 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,114 even if it does not contain any `.py` files. 2024-05-10T11:54:58,114 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,114 directory, all directories are treated like packages. 2024-05-10T11:54:58,114 ******************************************************************************** 2024-05-10T11:54:58,114 !! 2024-05-10T11:54:58,114 check.warn(importable) 2024-05-10T11:54:58,115 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd' is absent from the `packages` configuration. 2024-05-10T11:54:58,115 !! 2024-05-10T11:54:58,115 ******************************************************************************** 2024-05-10T11:54:58,115 ############################ 2024-05-10T11:54:58,115 # Package would be ignored # 2024-05-10T11:54:58,115 ############################ 2024-05-10T11:54:58,115 Python recognizes 'moleculekit.fileformats.dcd' as an importable package[^1], 2024-05-10T11:54:58,115 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,116 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,116 package, please make sure that 'moleculekit.fileformats.dcd' is explicitly added 2024-05-10T11:54:58,116 to the `packages` configuration field. 2024-05-10T11:54:58,116 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,116 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,116 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,117 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,117 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,117 If you don't want 'moleculekit.fileformats.dcd' to be distributed and are 2024-05-10T11:54:58,117 already explicitly excluding 'moleculekit.fileformats.dcd' via 2024-05-10T11:54:58,117 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,117 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,117 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,118 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,118 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,118 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,118 even if it does not contain any `.py` files. 2024-05-10T11:54:58,118 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,119 directory, all directories are treated like packages. 2024-05-10T11:54:58,119 ******************************************************************************** 2024-05-10T11:54:58,119 !! 2024-05-10T11:54:58,119 check.warn(importable) 2024-05-10T11:54:58,119 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd.include' is absent from the `packages` configuration. 2024-05-10T11:54:58,119 !! 2024-05-10T11:54:58,119 ******************************************************************************** 2024-05-10T11:54:58,120 ############################ 2024-05-10T11:54:58,120 # Package would be ignored # 2024-05-10T11:54:58,120 ############################ 2024-05-10T11:54:58,120 Python recognizes 'moleculekit.fileformats.dcd.include' as an importable package[^1], 2024-05-10T11:54:58,120 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,120 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,120 package, please make sure that 'moleculekit.fileformats.dcd.include' is explicitly added 2024-05-10T11:54:58,120 to the `packages` configuration field. 2024-05-10T11:54:58,121 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,121 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,121 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,121 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,121 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,121 If you don't want 'moleculekit.fileformats.dcd.include' to be distributed and are 2024-05-10T11:54:58,122 already explicitly excluding 'moleculekit.fileformats.dcd.include' via 2024-05-10T11:54:58,122 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,122 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,122 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,122 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,122 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,123 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,123 even if it does not contain any `.py` files. 2024-05-10T11:54:58,123 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,123 directory, all directories are treated like packages. 2024-05-10T11:54:58,123 ******************************************************************************** 2024-05-10T11:54:58,123 !! 2024-05-10T11:54:58,124 check.warn(importable) 2024-05-10T11:54:58,124 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.dcd.src' is absent from the `packages` configuration. 2024-05-10T11:54:58,124 !! 2024-05-10T11:54:58,124 ******************************************************************************** 2024-05-10T11:54:58,124 ############################ 2024-05-10T11:54:58,124 # Package would be ignored # 2024-05-10T11:54:58,124 ############################ 2024-05-10T11:54:58,125 Python recognizes 'moleculekit.fileformats.dcd.src' as an importable package[^1], 2024-05-10T11:54:58,125 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,125 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,125 package, please make sure that 'moleculekit.fileformats.dcd.src' is explicitly added 2024-05-10T11:54:58,125 to the `packages` configuration field. 2024-05-10T11:54:58,125 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,125 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,125 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,126 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,126 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,126 If you don't want 'moleculekit.fileformats.dcd.src' to be distributed and are 2024-05-10T11:54:58,126 already explicitly excluding 'moleculekit.fileformats.dcd.src' via 2024-05-10T11:54:58,126 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,126 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,127 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,127 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,127 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,127 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,127 even if it does not contain any `.py` files. 2024-05-10T11:54:58,128 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,128 directory, all directories are treated like packages. 2024-05-10T11:54:58,128 ******************************************************************************** 2024-05-10T11:54:58,128 !! 2024-05-10T11:54:58,128 check.warn(importable) 2024-05-10T11:54:58,128 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc' is absent from the `packages` configuration. 2024-05-10T11:54:58,128 !! 2024-05-10T11:54:58,129 ******************************************************************************** 2024-05-10T11:54:58,129 ############################ 2024-05-10T11:54:58,129 # Package would be ignored # 2024-05-10T11:54:58,129 ############################ 2024-05-10T11:54:58,129 Python recognizes 'moleculekit.fileformats.xtc' as an importable package[^1], 2024-05-10T11:54:58,129 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,129 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,129 package, please make sure that 'moleculekit.fileformats.xtc' is explicitly added 2024-05-10T11:54:58,129 to the `packages` configuration field. 2024-05-10T11:54:58,130 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,130 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,130 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,130 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,130 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,131 If you don't want 'moleculekit.fileformats.xtc' to be distributed and are 2024-05-10T11:54:58,131 already explicitly excluding 'moleculekit.fileformats.xtc' via 2024-05-10T11:54:58,131 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,131 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,131 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,131 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,131 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,132 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,132 even if it does not contain any `.py` files. 2024-05-10T11:54:58,132 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,132 directory, all directories are treated like packages. 2024-05-10T11:54:58,132 ******************************************************************************** 2024-05-10T11:54:58,132 !! 2024-05-10T11:54:58,132 check.warn(importable) 2024-05-10T11:54:58,133 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc.include' is absent from the `packages` configuration. 2024-05-10T11:54:58,133 !! 2024-05-10T11:54:58,133 ******************************************************************************** 2024-05-10T11:54:58,133 ############################ 2024-05-10T11:54:58,133 # Package would be ignored # 2024-05-10T11:54:58,133 ############################ 2024-05-10T11:54:58,133 Python recognizes 'moleculekit.fileformats.xtc.include' as an importable package[^1], 2024-05-10T11:54:58,133 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,134 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,134 package, please make sure that 'moleculekit.fileformats.xtc.include' is explicitly added 2024-05-10T11:54:58,134 to the `packages` configuration field. 2024-05-10T11:54:58,134 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,134 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,134 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,134 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,135 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,135 If you don't want 'moleculekit.fileformats.xtc.include' to be distributed and are 2024-05-10T11:54:58,135 already explicitly excluding 'moleculekit.fileformats.xtc.include' via 2024-05-10T11:54:58,135 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,135 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,135 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,136 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,136 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,136 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,136 even if it does not contain any `.py` files. 2024-05-10T11:54:58,136 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,136 directory, all directories are treated like packages. 2024-05-10T11:54:58,137 ******************************************************************************** 2024-05-10T11:54:58,137 !! 2024-05-10T11:54:58,137 check.warn(importable) 2024-05-10T11:54:58,137 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.fileformats.xtc.src' is absent from the `packages` configuration. 2024-05-10T11:54:58,137 !! 2024-05-10T11:54:58,137 ******************************************************************************** 2024-05-10T11:54:58,137 ############################ 2024-05-10T11:54:58,138 # Package would be ignored # 2024-05-10T11:54:58,138 ############################ 2024-05-10T11:54:58,138 Python recognizes 'moleculekit.fileformats.xtc.src' as an importable package[^1], 2024-05-10T11:54:58,138 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,138 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,138 package, please make sure that 'moleculekit.fileformats.xtc.src' is explicitly added 2024-05-10T11:54:58,138 to the `packages` configuration field. 2024-05-10T11:54:58,139 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,139 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,139 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,139 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,139 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,140 If you don't want 'moleculekit.fileformats.xtc.src' to be distributed and are 2024-05-10T11:54:58,140 already explicitly excluding 'moleculekit.fileformats.xtc.src' via 2024-05-10T11:54:58,140 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,140 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,140 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,140 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,141 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,141 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,141 even if it does not contain any `.py` files. 2024-05-10T11:54:58,141 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,141 directory, all directories are treated like packages. 2024-05-10T11:54:58,141 ******************************************************************************** 2024-05-10T11:54:58,142 !! 2024-05-10T11:54:58,142 check.warn(importable) 2024-05-10T11:54:58,142 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.cationpi' is absent from the `packages` configuration. 2024-05-10T11:54:58,142 !! 2024-05-10T11:54:58,142 ******************************************************************************** 2024-05-10T11:54:58,142 ############################ 2024-05-10T11:54:58,142 # Package would be ignored # 2024-05-10T11:54:58,142 ############################ 2024-05-10T11:54:58,143 Python recognizes 'moleculekit.interactions.cationpi' as an importable package[^1], 2024-05-10T11:54:58,143 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,143 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,143 package, please make sure that 'moleculekit.interactions.cationpi' is explicitly added 2024-05-10T11:54:58,143 to the `packages` configuration field. 2024-05-10T11:54:58,143 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,143 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,144 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,144 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,144 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,144 If you don't want 'moleculekit.interactions.cationpi' to be distributed and are 2024-05-10T11:54:58,144 already explicitly excluding 'moleculekit.interactions.cationpi' via 2024-05-10T11:54:58,145 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,145 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,145 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,145 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,145 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,146 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,146 even if it does not contain any `.py` files. 2024-05-10T11:54:58,146 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,146 directory, all directories are treated like packages. 2024-05-10T11:54:58,146 ******************************************************************************** 2024-05-10T11:54:58,146 !! 2024-05-10T11:54:58,146 check.warn(importable) 2024-05-10T11:54:58,147 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.hbonds' is absent from the `packages` configuration. 2024-05-10T11:54:58,147 !! 2024-05-10T11:54:58,147 ******************************************************************************** 2024-05-10T11:54:58,147 ############################ 2024-05-10T11:54:58,147 # Package would be ignored # 2024-05-10T11:54:58,147 ############################ 2024-05-10T11:54:58,148 Python recognizes 'moleculekit.interactions.hbonds' as an importable package[^1], 2024-05-10T11:54:58,148 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,148 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,148 package, please make sure that 'moleculekit.interactions.hbonds' is explicitly added 2024-05-10T11:54:58,148 to the `packages` configuration field. 2024-05-10T11:54:58,148 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,149 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,149 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,149 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,149 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,149 If you don't want 'moleculekit.interactions.hbonds' to be distributed and are 2024-05-10T11:54:58,150 already explicitly excluding 'moleculekit.interactions.hbonds' via 2024-05-10T11:54:58,150 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,150 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,150 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,150 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,150 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,151 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,151 even if it does not contain any `.py` files. 2024-05-10T11:54:58,151 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,151 directory, all directories are treated like packages. 2024-05-10T11:54:58,151 ******************************************************************************** 2024-05-10T11:54:58,151 !! 2024-05-10T11:54:58,152 check.warn(importable) 2024-05-10T11:54:58,152 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.pipi' is absent from the `packages` configuration. 2024-05-10T11:54:58,152 !! 2024-05-10T11:54:58,152 ******************************************************************************** 2024-05-10T11:54:58,152 ############################ 2024-05-10T11:54:58,152 # Package would be ignored # 2024-05-10T11:54:58,152 ############################ 2024-05-10T11:54:58,153 Python recognizes 'moleculekit.interactions.pipi' as an importable package[^1], 2024-05-10T11:54:58,153 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,153 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,153 package, please make sure that 'moleculekit.interactions.pipi' is explicitly added 2024-05-10T11:54:58,153 to the `packages` configuration field. 2024-05-10T11:54:58,154 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,154 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,154 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,154 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,155 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,155 If you don't want 'moleculekit.interactions.pipi' to be distributed and are 2024-05-10T11:54:58,155 already explicitly excluding 'moleculekit.interactions.pipi' via 2024-05-10T11:54:58,155 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,155 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,156 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,156 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,156 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,157 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,157 even if it does not contain any `.py` files. 2024-05-10T11:54:58,157 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,157 directory, all directories are treated like packages. 2024-05-10T11:54:58,157 ******************************************************************************** 2024-05-10T11:54:58,158 !! 2024-05-10T11:54:58,158 check.warn(importable) 2024-05-10T11:54:58,158 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.interactions.sigmahole' is absent from the `packages` configuration. 2024-05-10T11:54:58,158 !! 2024-05-10T11:54:58,159 ******************************************************************************** 2024-05-10T11:54:58,159 ############################ 2024-05-10T11:54:58,159 # Package would be ignored # 2024-05-10T11:54:58,159 ############################ 2024-05-10T11:54:58,159 Python recognizes 'moleculekit.interactions.sigmahole' as an importable package[^1], 2024-05-10T11:54:58,159 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,160 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,160 package, please make sure that 'moleculekit.interactions.sigmahole' is explicitly added 2024-05-10T11:54:58,160 to the `packages` configuration field. 2024-05-10T11:54:58,161 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,161 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,161 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,161 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,162 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,162 If you don't want 'moleculekit.interactions.sigmahole' to be distributed and are 2024-05-10T11:54:58,164 already explicitly excluding 'moleculekit.interactions.sigmahole' via 2024-05-10T11:54:58,165 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,165 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,166 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,167 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,169 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,171 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,172 even if it does not contain any `.py` files. 2024-05-10T11:54:58,172 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,173 directory, all directories are treated like packages. 2024-05-10T11:54:58,174 ******************************************************************************** 2024-05-10T11:54:58,175 !! 2024-05-10T11:54:58,176 check.warn(importable) 2024-05-10T11:54:58,177 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.occupancy_utils' is absent from the `packages` configuration. 2024-05-10T11:54:58,177 !! 2024-05-10T11:54:58,179 ******************************************************************************** 2024-05-10T11:54:58,180 ############################ 2024-05-10T11:54:58,180 # Package would be ignored # 2024-05-10T11:54:58,180 ############################ 2024-05-10T11:54:58,180 Python recognizes 'moleculekit.occupancy_utils' as an importable package[^1], 2024-05-10T11:54:58,180 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,181 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,181 package, please make sure that 'moleculekit.occupancy_utils' is explicitly added 2024-05-10T11:54:58,181 to the `packages` configuration field. 2024-05-10T11:54:58,182 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,182 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,182 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,182 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,183 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,183 If you don't want 'moleculekit.occupancy_utils' to be distributed and are 2024-05-10T11:54:58,183 already explicitly excluding 'moleculekit.occupancy_utils' via 2024-05-10T11:54:58,184 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,184 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,184 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,185 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,185 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,186 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,186 even if it does not contain any `.py` files. 2024-05-10T11:54:58,186 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,187 directory, all directories are treated like packages. 2024-05-10T11:54:58,187 ******************************************************************************** 2024-05-10T11:54:58,187 !! 2024-05-10T11:54:58,188 check.warn(importable) 2024-05-10T11:54:58,188 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share' is absent from the `packages` configuration. 2024-05-10T11:54:58,188 !! 2024-05-10T11:54:58,188 ******************************************************************************** 2024-05-10T11:54:58,189 ############################ 2024-05-10T11:54:58,189 # Package would be ignored # 2024-05-10T11:54:58,189 ############################ 2024-05-10T11:54:58,189 Python recognizes 'moleculekit.share' as an importable package[^1], 2024-05-10T11:54:58,190 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,190 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,190 package, please make sure that 'moleculekit.share' is explicitly added 2024-05-10T11:54:58,190 to the `packages` configuration field. 2024-05-10T11:54:58,191 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,191 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,191 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,191 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,192 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,192 If you don't want 'moleculekit.share' to be distributed and are 2024-05-10T11:54:58,192 already explicitly excluding 'moleculekit.share' via 2024-05-10T11:54:58,192 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,192 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,193 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,193 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,193 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,194 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,194 even if it does not contain any `.py` files. 2024-05-10T11:54:58,194 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,194 directory, all directories are treated like packages. 2024-05-10T11:54:58,194 ******************************************************************************** 2024-05-10T11:54:58,195 !! 2024-05-10T11:54:58,195 check.warn(importable) 2024-05-10T11:54:58,195 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share.atomselect' is absent from the `packages` configuration. 2024-05-10T11:54:58,195 !! 2024-05-10T11:54:58,196 ******************************************************************************** 2024-05-10T11:54:58,196 ############################ 2024-05-10T11:54:58,196 # Package would be ignored # 2024-05-10T11:54:58,196 ############################ 2024-05-10T11:54:58,197 Python recognizes 'moleculekit.share.atomselect' as an importable package[^1], 2024-05-10T11:54:58,197 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,198 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,199 package, please make sure that 'moleculekit.share.atomselect' is explicitly added 2024-05-10T11:54:58,199 to the `packages` configuration field. 2024-05-10T11:54:58,200 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,200 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,201 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,201 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,202 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,203 If you don't want 'moleculekit.share.atomselect' to be distributed and are 2024-05-10T11:54:58,203 already explicitly excluding 'moleculekit.share.atomselect' via 2024-05-10T11:54:58,204 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,204 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,204 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,205 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,206 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,207 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,208 even if it does not contain any `.py` files. 2024-05-10T11:54:58,208 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,208 directory, all directories are treated like packages. 2024-05-10T11:54:58,209 ******************************************************************************** 2024-05-10T11:54:58,210 !! 2024-05-10T11:54:58,210 check.warn(importable) 2024-05-10T11:54:58,210 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.share.pdb2pqr.residues' is absent from the `packages` configuration. 2024-05-10T11:54:58,211 !! 2024-05-10T11:54:58,212 ******************************************************************************** 2024-05-10T11:54:58,212 ############################ 2024-05-10T11:54:58,212 # Package would be ignored # 2024-05-10T11:54:58,213 ############################ 2024-05-10T11:54:58,213 Python recognizes 'moleculekit.share.pdb2pqr.residues' as an importable package[^1], 2024-05-10T11:54:58,214 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,215 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,215 package, please make sure that 'moleculekit.share.pdb2pqr.residues' is explicitly added 2024-05-10T11:54:58,215 to the `packages` configuration field. 2024-05-10T11:54:58,216 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,216 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,217 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,217 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,218 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,218 If you don't want 'moleculekit.share.pdb2pqr.residues' to be distributed and are 2024-05-10T11:54:58,219 already explicitly excluding 'moleculekit.share.pdb2pqr.residues' via 2024-05-10T11:54:58,219 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,220 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,220 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,221 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,222 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,224 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,224 even if it does not contain any `.py` files. 2024-05-10T11:54:58,225 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,225 directory, all directories are treated like packages. 2024-05-10T11:54:58,225 ******************************************************************************** 2024-05-10T11:54:58,226 !! 2024-05-10T11:54:58,226 check.warn(importable) 2024-05-10T11:54:58,226 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign' is absent from the `packages` configuration. 2024-05-10T11:54:58,226 !! 2024-05-10T11:54:58,227 ******************************************************************************** 2024-05-10T11:54:58,227 ############################ 2024-05-10T11:54:58,227 # Package would be ignored # 2024-05-10T11:54:58,227 ############################ 2024-05-10T11:54:58,227 Python recognizes 'moleculekit.tmalign' as an importable package[^1], 2024-05-10T11:54:58,227 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,228 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,228 package, please make sure that 'moleculekit.tmalign' is explicitly added 2024-05-10T11:54:58,228 to the `packages` configuration field. 2024-05-10T11:54:58,229 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,229 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,229 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,230 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,230 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,230 If you don't want 'moleculekit.tmalign' to be distributed and are 2024-05-10T11:54:58,231 already explicitly excluding 'moleculekit.tmalign' via 2024-05-10T11:54:58,231 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,231 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,232 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,232 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,232 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,233 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,233 even if it does not contain any `.py` files. 2024-05-10T11:54:58,233 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,234 directory, all directories are treated like packages. 2024-05-10T11:54:58,234 ******************************************************************************** 2024-05-10T11:54:58,234 !! 2024-05-10T11:54:58,235 check.warn(importable) 2024-05-10T11:54:58,235 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.include' is absent from the `packages` configuration. 2024-05-10T11:54:58,235 !! 2024-05-10T11:54:58,235 ******************************************************************************** 2024-05-10T11:54:58,235 ############################ 2024-05-10T11:54:58,236 # Package would be ignored # 2024-05-10T11:54:58,236 ############################ 2024-05-10T11:54:58,236 Python recognizes 'moleculekit.tmalign.include' as an importable package[^1], 2024-05-10T11:54:58,236 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,237 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,237 package, please make sure that 'moleculekit.tmalign.include' is explicitly added 2024-05-10T11:54:58,237 to the `packages` configuration field. 2024-05-10T11:54:58,237 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,237 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,238 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,238 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,238 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,239 If you don't want 'moleculekit.tmalign.include' to be distributed and are 2024-05-10T11:54:58,239 already explicitly excluding 'moleculekit.tmalign.include' via 2024-05-10T11:54:58,239 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,239 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,239 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,240 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,240 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,240 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,241 even if it does not contain any `.py` files. 2024-05-10T11:54:58,241 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,241 directory, all directories are treated like packages. 2024-05-10T11:54:58,241 ******************************************************************************** 2024-05-10T11:54:58,242 !! 2024-05-10T11:54:58,242 check.warn(importable) 2024-05-10T11:54:58,242 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.tmalign.src' is absent from the `packages` configuration. 2024-05-10T11:54:58,243 !! 2024-05-10T11:54:58,243 ******************************************************************************** 2024-05-10T11:54:58,244 ############################ 2024-05-10T11:54:58,244 # Package would be ignored # 2024-05-10T11:54:58,245 ############################ 2024-05-10T11:54:58,245 Python recognizes 'moleculekit.tmalign.src' as an importable package[^1], 2024-05-10T11:54:58,245 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,246 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,247 package, please make sure that 'moleculekit.tmalign.src' is explicitly added 2024-05-10T11:54:58,247 to the `packages` configuration field. 2024-05-10T11:54:58,248 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,248 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,249 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,249 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,250 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,251 If you don't want 'moleculekit.tmalign.src' to be distributed and are 2024-05-10T11:54:58,251 already explicitly excluding 'moleculekit.tmalign.src' via 2024-05-10T11:54:58,252 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,252 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,253 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,253 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,254 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,255 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,255 even if it does not contain any `.py` files. 2024-05-10T11:54:58,256 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,256 directory, all directories are treated like packages. 2024-05-10T11:54:58,256 ******************************************************************************** 2024-05-10T11:54:58,257 !! 2024-05-10T11:54:58,257 check.warn(importable) 2024-05-10T11:54:58,257 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:207: _Warning: Package 'moleculekit.wrapping' is absent from the `packages` configuration. 2024-05-10T11:54:58,258 !! 2024-05-10T11:54:58,258 ******************************************************************************** 2024-05-10T11:54:58,259 ############################ 2024-05-10T11:54:58,259 # Package would be ignored # 2024-05-10T11:54:58,259 ############################ 2024-05-10T11:54:58,260 Python recognizes 'moleculekit.wrapping' as an importable package[^1], 2024-05-10T11:54:58,260 but it is absent from setuptools' `packages` configuration. 2024-05-10T11:54:58,260 This leads to an ambiguous overall configuration. If you want to distribute this 2024-05-10T11:54:58,261 package, please make sure that 'moleculekit.wrapping' is explicitly added 2024-05-10T11:54:58,261 to the `packages` configuration field. 2024-05-10T11:54:58,262 Alternatively, you can also rely on setuptools' discovery methods 2024-05-10T11:54:58,262 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-05-10T11:54:58,262 instead of `find_packages(...)`/`find:`). 2024-05-10T11:54:58,262 You can read more about "package discovery" on setuptools documentation page: 2024-05-10T11:54:58,263 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-05-10T11:54:58,263 If you don't want 'moleculekit.wrapping' to be distributed and are 2024-05-10T11:54:58,264 already explicitly excluding 'moleculekit.wrapping' via 2024-05-10T11:54:58,264 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-05-10T11:54:58,264 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-05-10T11:54:58,264 combination with a more fine grained `package-data` configuration. 2024-05-10T11:54:58,265 You can read more about "package data files" on setuptools documentation page: 2024-05-10T11:54:58,265 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-05-10T11:54:58,266 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-05-10T11:54:58,266 even if it does not contain any `.py` files. 2024-05-10T11:54:58,267 On the other hand, currently there is no concept of package data 2024-05-10T11:54:58,267 directory, all directories are treated like packages. 2024-05-10T11:54:58,267 ******************************************************************************** 2024-05-10T11:54:58,268 !! 2024-05-10T11:54:58,268 check.warn(importable) 2024-05-10T11:54:58,268 copying moleculekit/logging.ini -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:58,268 copying moleculekit/vmd_wrapper -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:58,269 creating build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-05-10T11:54:58,269 copying moleculekit/atomselect_utils/atomselect_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-05-10T11:54:58,269 copying moleculekit/atomselect_utils/atomselect_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-05-10T11:54:58,269 creating build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-05-10T11:54:58,269 copying moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-05-10T11:54:58,269 copying moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-05-10T11:54:58,269 creating build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-05-10T11:54:58,270 copying moleculekit/cython_utils/cython_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-05-10T11:54:58,270 copying moleculekit/cython_utils/cython_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-05-10T11:54:58,272 creating build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-05-10T11:54:58,273 copying moleculekit/distance_utils/distance_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-05-10T11:54:58,297 copying moleculekit/distance_utils/distance_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-05-10T11:54:58,299 creating build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-05-10T11:54:58,300 copying moleculekit/occupancy_utils/occupancy_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-05-10T11:54:58,318 copying moleculekit/occupancy_utils/occupancy_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-05-10T11:54:58,320 creating build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-05-10T11:54:58,321 copying moleculekit/share/ALA.cif -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-05-10T11:54:58,324 copying moleculekit/share/backbone.cif -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-05-10T11:54:58,326 copying moleculekit/share/opm_sequences.json -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-05-10T11:54:58,537 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect 2024-05-10T11:54:58,538 copying moleculekit/share/atomselect/atomselect.json -> build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect 2024-05-10T11:54:58,541 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr 2024-05-10T11:54:58,542 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,543 copying moleculekit/share/pdb2pqr/residues/.gitkeep -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,545 copying moleculekit/share/pdb2pqr/residues/004.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,547 copying moleculekit/share/pdb2pqr/residues/004.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,550 copying moleculekit/share/pdb2pqr/residues/03Y.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,552 copying moleculekit/share/pdb2pqr/residues/03Y.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,554 copying moleculekit/share/pdb2pqr/residues/0A1.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,556 copying moleculekit/share/pdb2pqr/residues/0A1.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,558 copying moleculekit/share/pdb2pqr/residues/0AF.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,560 copying moleculekit/share/pdb2pqr/residues/0AF.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,562 copying moleculekit/share/pdb2pqr/residues/0BN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,564 copying moleculekit/share/pdb2pqr/residues/0BN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,566 copying moleculekit/share/pdb2pqr/residues/1MH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,568 copying moleculekit/share/pdb2pqr/residues/1MH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,570 copying moleculekit/share/pdb2pqr/residues/2AS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,573 copying moleculekit/share/pdb2pqr/residues/2AS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,575 copying moleculekit/share/pdb2pqr/residues/2GX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,577 copying moleculekit/share/pdb2pqr/residues/2GX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,579 copying moleculekit/share/pdb2pqr/residues/2ML.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,582 copying moleculekit/share/pdb2pqr/residues/2ML.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,583 copying moleculekit/share/pdb2pqr/residues/2MR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,585 copying moleculekit/share/pdb2pqr/residues/2MR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,588 copying moleculekit/share/pdb2pqr/residues/4IN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,590 copying moleculekit/share/pdb2pqr/residues/4IN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,592 copying moleculekit/share/pdb2pqr/residues/4PH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,594 copying moleculekit/share/pdb2pqr/residues/4PH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,596 copying moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,598 copying moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,600 copying moleculekit/share/pdb2pqr/residues/5JP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,602 copying moleculekit/share/pdb2pqr/residues/5JP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,604 copying moleculekit/share/pdb2pqr/residues/AA4.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,606 copying moleculekit/share/pdb2pqr/residues/AA4.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,608 copying moleculekit/share/pdb2pqr/residues/ABA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,610 copying moleculekit/share/pdb2pqr/residues/ABA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,612 copying moleculekit/share/pdb2pqr/residues/AHP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,614 copying moleculekit/share/pdb2pqr/residues/AHP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,616 copying moleculekit/share/pdb2pqr/residues/ALC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,618 copying moleculekit/share/pdb2pqr/residues/ALC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,620 copying moleculekit/share/pdb2pqr/residues/ALN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,622 copying moleculekit/share/pdb2pqr/residues/ALN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,624 copying moleculekit/share/pdb2pqr/residues/ALY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,626 copying moleculekit/share/pdb2pqr/residues/ALY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,628 copying moleculekit/share/pdb2pqr/residues/APD.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,630 copying moleculekit/share/pdb2pqr/residues/APD.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,633 copying moleculekit/share/pdb2pqr/residues/BB8.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,635 copying moleculekit/share/pdb2pqr/residues/BB8.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,637 copying moleculekit/share/pdb2pqr/residues/BCS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,639 copying moleculekit/share/pdb2pqr/residues/BCS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,641 copying moleculekit/share/pdb2pqr/residues/BTK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,643 copying moleculekit/share/pdb2pqr/residues/BTK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,645 copying moleculekit/share/pdb2pqr/residues/CCS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,647 copying moleculekit/share/pdb2pqr/residues/CCS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,650 copying moleculekit/share/pdb2pqr/residues/CGU.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,652 copying moleculekit/share/pdb2pqr/residues/CGU.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,654 copying moleculekit/share/pdb2pqr/residues/CSA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,656 copying moleculekit/share/pdb2pqr/residues/CSA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,658 copying moleculekit/share/pdb2pqr/residues/CSO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,660 copying moleculekit/share/pdb2pqr/residues/CSO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,662 copying moleculekit/share/pdb2pqr/residues/CSP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,664 copying moleculekit/share/pdb2pqr/residues/CSP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,666 copying moleculekit/share/pdb2pqr/residues/CSS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,668 copying moleculekit/share/pdb2pqr/residues/CSS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,670 copying moleculekit/share/pdb2pqr/residues/D4P.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,672 copying moleculekit/share/pdb2pqr/residues/D4P.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,674 copying moleculekit/share/pdb2pqr/residues/DA2.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,676 copying moleculekit/share/pdb2pqr/residues/DA2.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,678 copying moleculekit/share/pdb2pqr/residues/DAB.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,680 copying moleculekit/share/pdb2pqr/residues/DAB.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,682 copying moleculekit/share/pdb2pqr/residues/DAH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,684 copying moleculekit/share/pdb2pqr/residues/DAH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,686 copying moleculekit/share/pdb2pqr/residues/DPP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,688 copying moleculekit/share/pdb2pqr/residues/DPP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,690 copying moleculekit/share/pdb2pqr/residues/ESC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,692 copying moleculekit/share/pdb2pqr/residues/ESC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,694 copying moleculekit/share/pdb2pqr/residues/FGL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,696 copying moleculekit/share/pdb2pqr/residues/FGL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,698 copying moleculekit/share/pdb2pqr/residues/GHG.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,700 copying moleculekit/share/pdb2pqr/residues/GHG.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,702 copying moleculekit/share/pdb2pqr/residues/GME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,704 copying moleculekit/share/pdb2pqr/residues/GME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,706 copying moleculekit/share/pdb2pqr/residues/GNC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,707 copying moleculekit/share/pdb2pqr/residues/GNC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,710 copying moleculekit/share/pdb2pqr/residues/HHK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,711 copying moleculekit/share/pdb2pqr/residues/HHK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,714 copying moleculekit/share/pdb2pqr/residues/HLU.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,715 copying moleculekit/share/pdb2pqr/residues/HLU.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,717 copying moleculekit/share/pdb2pqr/residues/HLX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,719 copying moleculekit/share/pdb2pqr/residues/HLX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,721 copying moleculekit/share/pdb2pqr/residues/HOX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,723 copying moleculekit/share/pdb2pqr/residues/HOX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,725 copying moleculekit/share/pdb2pqr/residues/HPE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,726 copying moleculekit/share/pdb2pqr/residues/HPE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,728 copying moleculekit/share/pdb2pqr/residues/HQA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,730 copying moleculekit/share/pdb2pqr/residues/HQA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,732 copying moleculekit/share/pdb2pqr/residues/HTR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,734 copying moleculekit/share/pdb2pqr/residues/HTR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,736 copying moleculekit/share/pdb2pqr/residues/HYP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,738 copying moleculekit/share/pdb2pqr/residues/HYP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,740 copying moleculekit/share/pdb2pqr/residues/I2M.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,742 copying moleculekit/share/pdb2pqr/residues/I2M.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,744 copying moleculekit/share/pdb2pqr/residues/IGL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,745 copying moleculekit/share/pdb2pqr/residues/IGL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,748 copying moleculekit/share/pdb2pqr/residues/IIL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,750 copying moleculekit/share/pdb2pqr/residues/IIL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,751 copying moleculekit/share/pdb2pqr/residues/IML.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,754 copying moleculekit/share/pdb2pqr/residues/IML.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,756 copying moleculekit/share/pdb2pqr/residues/KYN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,758 copying moleculekit/share/pdb2pqr/residues/KYN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,760 copying moleculekit/share/pdb2pqr/residues/LME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,762 copying moleculekit/share/pdb2pqr/residues/LME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,764 copying moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,766 copying moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,768 copying moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,770 copying moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,772 copying moleculekit/share/pdb2pqr/residues/M3L.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,773 copying moleculekit/share/pdb2pqr/residues/M3L.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,776 copying moleculekit/share/pdb2pqr/residues/ME0.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,778 copying moleculekit/share/pdb2pqr/residues/ME0.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,780 copying moleculekit/share/pdb2pqr/residues/MEA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,782 copying moleculekit/share/pdb2pqr/residues/MEA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,784 copying moleculekit/share/pdb2pqr/residues/MEN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,786 copying moleculekit/share/pdb2pqr/residues/MEN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,787 copying moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,789 copying moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,791 copying moleculekit/share/pdb2pqr/residues/MLE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,793 copying moleculekit/share/pdb2pqr/residues/MLE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,795 copying moleculekit/share/pdb2pqr/residues/MLY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,797 copying moleculekit/share/pdb2pqr/residues/MLY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,799 copying moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,801 copying moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,803 copying moleculekit/share/pdb2pqr/residues/MME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,805 copying moleculekit/share/pdb2pqr/residues/MME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,807 copying moleculekit/share/pdb2pqr/residues/MMO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,809 copying moleculekit/share/pdb2pqr/residues/MMO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,811 copying moleculekit/share/pdb2pqr/residues/MVA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,813 copying moleculekit/share/pdb2pqr/residues/MVA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,815 copying moleculekit/share/pdb2pqr/residues/NAL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,817 copying moleculekit/share/pdb2pqr/residues/NAL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,819 copying moleculekit/share/pdb2pqr/residues/NCY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,821 copying moleculekit/share/pdb2pqr/residues/NCY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,823 copying moleculekit/share/pdb2pqr/residues/NLE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,825 copying moleculekit/share/pdb2pqr/residues/NLE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,827 copying moleculekit/share/pdb2pqr/residues/NVA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,829 copying moleculekit/share/pdb2pqr/residues/NVA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,831 copying moleculekit/share/pdb2pqr/residues/NZC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,833 copying moleculekit/share/pdb2pqr/residues/NZC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,835 copying moleculekit/share/pdb2pqr/residues/OCY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,836 copying moleculekit/share/pdb2pqr/residues/OCY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,838 copying moleculekit/share/pdb2pqr/residues/OMX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,840 copying moleculekit/share/pdb2pqr/residues/OMX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,842 copying moleculekit/share/pdb2pqr/residues/ONL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,844 copying moleculekit/share/pdb2pqr/residues/ONL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,846 copying moleculekit/share/pdb2pqr/residues/ORM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,848 copying moleculekit/share/pdb2pqr/residues/ORM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,850 copying moleculekit/share/pdb2pqr/residues/P1L.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,852 copying moleculekit/share/pdb2pqr/residues/P1L.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,855 copying moleculekit/share/pdb2pqr/residues/PCA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,857 copying moleculekit/share/pdb2pqr/residues/PCA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,859 copying moleculekit/share/pdb2pqr/residues/PRK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,861 copying moleculekit/share/pdb2pqr/residues/PRK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,863 copying moleculekit/share/pdb2pqr/residues/PTR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,865 copying moleculekit/share/pdb2pqr/residues/PTR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,867 copying moleculekit/share/pdb2pqr/residues/SEP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,869 copying moleculekit/share/pdb2pqr/residues/SEP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,871 copying moleculekit/share/pdb2pqr/residues/TPO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,873 copying moleculekit/share/pdb2pqr/residues/TPO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,875 copying moleculekit/share/pdb2pqr/residues/TRO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,877 copying moleculekit/share/pdb2pqr/residues/TRO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,879 copying moleculekit/share/pdb2pqr/residues/TY2.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,880 copying moleculekit/share/pdb2pqr/residues/TY2.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,883 copying moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,884 copying moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,886 copying moleculekit/share/pdb2pqr/residues/YCM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,888 copying moleculekit/share/pdb2pqr/residues/YCM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,890 copying moleculekit/share/pdb2pqr/residues/YNM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,892 copying moleculekit/share/pdb2pqr/residues/YNM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-05-10T11:54:58,894 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-05-10T11:54:58,895 copying moleculekit/tmalign/tmalign_util.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-05-10T11:54:58,914 copying moleculekit/tmalign/tmalign_util.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-05-10T11:54:58,916 copying moleculekit/tmalign/tmalignlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-05-10T11:54:58,918 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include 2024-05-10T11:54:58,919 copying moleculekit/tmalign/include/TMAlign.h -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include 2024-05-10T11:54:58,921 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-05-10T11:54:58,922 copying moleculekit/tmalign/src/TMAlign.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-05-10T11:54:58,928 creating build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-05-10T11:54:58,929 copying moleculekit/wrapping/wrapping.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-05-10T11:54:58,957 copying moleculekit/wrapping/wrapping.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-05-10T11:54:58,959 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-05-10T11:54:58,960 copying moleculekit/fileformats/binpos/binpos.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-05-10T11:54:58,983 copying moleculekit/fileformats/binpos/binpos.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-05-10T11:54:58,986 copying moleculekit/fileformats/binpos/binposlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-05-10T11:54:58,988 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-05-10T11:54:58,989 copying moleculekit/fileformats/binpos/include/binposplugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-05-10T11:54:58,992 copying moleculekit/fileformats/binpos/include/largefiles.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-05-10T11:54:58,994 copying moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-05-10T11:54:58,998 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-05-10T11:54:58,999 copying moleculekit/fileformats/binpos/src/binposplugin.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-05-10T11:54:59,002 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-05-10T11:54:59,003 copying moleculekit/fileformats/dcd/dcd.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-05-10T11:54:59,022 copying moleculekit/fileformats/dcd/dcd.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-05-10T11:54:59,025 copying moleculekit/fileformats/dcd/dcdlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-05-10T11:54:59,028 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-05-10T11:54:59,029 copying moleculekit/fileformats/dcd/include/dcdplugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-05-10T11:54:59,031 copying moleculekit/fileformats/dcd/include/endianswap.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-05-10T11:54:59,034 copying moleculekit/fileformats/dcd/include/fastio.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-05-10T11:54:59,037 copying moleculekit/fileformats/dcd/include/largefiles.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-05-10T11:54:59,039 copying moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-05-10T11:54:59,043 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-05-10T11:54:59,044 copying moleculekit/fileformats/dcd/src/dcdplugin.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-05-10T11:54:59,048 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-05-10T11:54:59,049 copying moleculekit/fileformats/xtc/trr.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-05-10T11:54:59,090 copying moleculekit/fileformats/xtc/trr.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-05-10T11:54:59,094 copying moleculekit/fileformats/xtc/trrlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-05-10T11:54:59,097 copying moleculekit/fileformats/xtc/xdrlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-05-10T11:54:59,099 copying moleculekit/fileformats/xtc/xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-05-10T11:54:59,128 copying moleculekit/fileformats/xtc/xtc.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-05-10T11:54:59,131 copying moleculekit/fileformats/xtc/xtclib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-05-10T11:54:59,134 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-05-10T11:54:59,135 copying moleculekit/fileformats/xtc/include/trr_header.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-05-10T11:54:59,138 copying moleculekit/fileformats/xtc/include/xdr_seek.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-05-10T11:54:59,141 copying moleculekit/fileformats/xtc/include/xdrfile.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-05-10T11:54:59,145 copying moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-05-10T11:54:59,148 copying moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-05-10T11:54:59,150 copying moleculekit/fileformats/xtc/include/xtc.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-05-10T11:54:59,153 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-05-10T11:54:59,154 copying moleculekit/fileformats/xtc/src/xdr_seek.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-05-10T11:54:59,157 copying moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-05-10T11:54:59,161 copying moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-05-10T11:54:59,165 copying moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-05-10T11:54:59,167 copying moleculekit/fileformats/xtc/src/xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-05-10T11:54:59,171 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-05-10T11:54:59,172 copying moleculekit/interactions/cationpi/cationpi.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-05-10T11:54:59,198 copying moleculekit/interactions/cationpi/cationpi.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-05-10T11:54:59,201 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-05-10T11:54:59,202 copying moleculekit/interactions/hbonds/hbonds.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-05-10T11:54:59,235 copying moleculekit/interactions/hbonds/hbonds.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-05-10T11:54:59,238 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-05-10T11:54:59,239 copying moleculekit/interactions/pipi/pipi.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-05-10T11:54:59,266 copying moleculekit/interactions/pipi/pipi.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-05-10T11:54:59,269 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-05-10T11:54:59,270 copying moleculekit/interactions/sigmahole/sigmahole.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-05-10T11:54:59,291 copying moleculekit/interactions/sigmahole/sigmahole.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-05-10T11:54:59,303 UPDATING build/lib.linux-armv7l-cpython-39/moleculekit/_version.py 2024-05-10T11:54:59,304 set build/lib.linux-armv7l-cpython-39/moleculekit/_version.py to '1.8.32' 2024-05-10T11:54:59,304 running build_ext 2024-05-10T11:54:59,318 building 'moleculekit.interactions.hbonds' extension 2024-05-10T11:54:59,319 creating build/temp.linux-armv7l-cpython-39 2024-05-10T11:54:59,319 creating build/temp.linux-armv7l-cpython-39/moleculekit 2024-05-10T11:54:59,320 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions 2024-05-10T11:54:59,320 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-05-10T11:54:59,321 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/interactions/hbonds/hbonds.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.o -O3 2024-05-10T11:54:59,580 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T11:54:59,580 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T11:54:59,581 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T11:54:59,581 from moleculekit/interactions/hbonds/hbonds.cpp:1265: 2024-05-10T11:54:59,581 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T11:54:59,581 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T11:54:59,581 | ^~~~~~~ 2024-05-10T11:55:22,727 moleculekit/interactions/hbonds/hbonds.cpp: In function ‘PyObject* __pyx_pw_11moleculekit_12interactions_6hbonds_1calculate(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-05-10T11:55:22,728 moleculekit/interactions/hbonds/hbonds.cpp:21019:52: warning: ‘__pyx_v_d_idx_h’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T11:55:22,728 21019 | (__pyx_v_results[__pyx_v_f]).push_back(__pyx_v_d_idx_h); 2024-05-10T11:55:22,728 | ^~~~~~~~~~~~~~~ 2024-05-10T11:55:22,728 moleculekit/interactions/hbonds/hbonds.cpp:20032:57: note: ‘__pyx_v_d_idx_h’ was declared here 2024-05-10T11:55:22,729 20032 | __pyx_t_11moleculekit_12interactions_6hbonds_UINT32_t __pyx_v_d_idx_h; 2024-05-10T11:55:22,729 | ^~~~~~~~~~~~~~~ 2024-05-10T11:55:25,899 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so 2024-05-10T11:55:26,216 building 'moleculekit.interactions.pipi' extension 2024-05-10T11:55:26,216 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-05-10T11:55:26,217 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/interactions/pipi/pipi.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.o -O3 2024-05-10T11:55:26,450 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T11:55:26,450 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T11:55:26,451 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T11:55:26,451 from moleculekit/interactions/pipi/pipi.cpp:1265: 2024-05-10T11:55:26,451 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T11:55:26,451 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T11:55:26,451 | ^~~~~~~ 2024-05-10T11:55:54,630 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so 2024-05-10T11:55:54,950 building 'moleculekit.interactions.cationpi' extension 2024-05-10T11:55:54,951 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-05-10T11:55:54,952 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/interactions/cationpi/cationpi.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.o -O3 2024-05-10T11:55:55,186 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T11:55:55,186 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T11:55:55,186 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T11:55:55,186 from moleculekit/interactions/cationpi/cationpi.cpp:1265: 2024-05-10T11:55:55,186 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T11:55:55,186 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T11:55:55,187 | ^~~~~~~ 2024-05-10T11:56:23,184 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so 2024-05-10T11:56:23,498 building 'moleculekit.interactions.sigmahole' extension 2024-05-10T11:56:23,499 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-05-10T11:56:23,500 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/interactions/sigmahole/sigmahole.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.o -O3 2024-05-10T11:56:23,737 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T11:56:23,737 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T11:56:23,737 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T11:56:23,737 from moleculekit/interactions/sigmahole/sigmahole.cpp:1265: 2024-05-10T11:56:23,737 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T11:56:23,738 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T11:56:23,738 | ^~~~~~~ 2024-05-10T11:56:51,138 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so 2024-05-10T11:56:51,458 building 'moleculekit.wrapping' extension 2024-05-10T11:56:51,458 creating build/temp.linux-armv7l-cpython-39/moleculekit/wrapping 2024-05-10T11:56:51,459 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/wrapping/wrapping.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.o -O3 2024-05-10T11:56:51,693 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T11:56:51,693 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T11:56:51,693 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T11:56:51,693 from moleculekit/wrapping/wrapping.cpp:1265: 2024-05-10T11:56:51,694 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T11:56:51,694 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T11:56:51,694 | ^~~~~~~ 2024-05-10T11:57:17,561 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so 2024-05-10T11:57:17,791 building 'moleculekit.bondguesser_utils' extension 2024-05-10T11:57:17,792 creating build/temp.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-05-10T11:57:17,793 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/bondguesser_utils/bondguesser_utils.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.o -O3 2024-05-10T11:57:18,031 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T11:57:18,032 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T11:57:18,032 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T11:57:18,032 from moleculekit/bondguesser_utils/bondguesser_utils.cpp:1265: 2024-05-10T11:57:18,032 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T11:57:18,032 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T11:57:18,032 | ^~~~~~~ 2024-05-10T11:57:19,585 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)’: 2024-05-10T11:57:19,585 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] 2024-05-10T11:57:19,585 19801 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-05-10T11:57:19,585 | ~~~~~~~~~~^~~~~~~~~~~ 2024-05-10T11:57:19,585 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] 2024-05-10T11:57:19,586 19813 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-05-10T11:57:19,586 | ~~~~~~~~~~^~~~~~~~~~~ 2024-05-10T11:57:19,586 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] 2024-05-10T11:57:19,586 19825 | for (__pyx_t_9 = 0; __pyx_t_9 < __pyx_t_8; __pyx_t_9+=1) { 2024-05-10T11:57:19,586 | ~~~~~~~~~~^~~~~~~~~~~ 2024-05-10T11:57:19,586 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19864:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,586 19864 | __pyx_t_12 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-05-10T11:57:19,587 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,587 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19903:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,587 19903 | __pyx_t_12 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-05-10T11:57:19,587 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,587 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19942:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,587 19942 | __pyx_t_12 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-05-10T11:57:19,587 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,588 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19981:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,588 19981 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-05-10T11:57:19,588 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,588 moleculekit/bondguesser_utils/bondguesser_utils.cpp:19987:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,588 19987 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-05-10T11:57:19,588 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,589 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20028:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,589 20028 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-05-10T11:57:19,589 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,589 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20034:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,589 20034 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-05-10T11:57:19,589 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,589 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20075:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,590 20075 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-05-10T11:57:19,590 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,590 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20081:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,590 20081 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-05-10T11:57:19,590 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,590 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20122:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,590 20122 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-05-10T11:57:19,590 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,591 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20175:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,591 20175 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-05-10T11:57:19,591 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,591 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20222:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,591 20222 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-05-10T11:57:19,591 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,591 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20263:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,592 20263 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-05-10T11:57:19,592 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,592 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20269:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,592 20269 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-05-10T11:57:19,592 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,592 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20275:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,592 20275 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-05-10T11:57:19,593 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,593 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20322:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,593 20322 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-05-10T11:57:19,593 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,593 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20328:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,593 20328 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-05-10T11:57:19,593 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,594 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20369:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,594 20369 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-05-10T11:57:19,594 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,594 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20381:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,594 20381 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-05-10T11:57:19,594 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,594 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20434:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-05-10T11:57:19,595 20434 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-05-10T11:57:19,595 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,614 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)’: 2024-05-10T11:57:19,614 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] 2024-05-10T11:57:19,614 21056 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_n_boxes); 2024-05-10T11:57:19,614 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~ 2024-05-10T11:57:19,614 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] 2024-05-10T11:57:19,614 21093 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_boxidx); 2024-05-10T11:57:19,615 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-05-10T11:57:42,710 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so 2024-05-10T11:57:43,007 building 'moleculekit.atomselect_utils' extension 2024-05-10T11:57:43,008 creating build/temp.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-05-10T11:57:43,009 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/atomselect_utils/atomselect_utils.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.o -O3 2024-05-10T11:57:43,244 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T11:57:43,244 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T11:57:43,244 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T11:57:43,244 from moleculekit/atomselect_utils/atomselect_utils.cpp:1282: 2024-05-10T11:57:43,245 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T11:57:43,245 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T11:57:43,245 | ^~~~~~~ 2024-05-10T11:57:44,969 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 >&)’: 2024-05-10T11:57:44,969 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] 2024-05-10T11:57:44,969 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); 2024-05-10T11:57:44,969 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-05-10T11:57:44,975 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 >&)’: 2024-05-10T11:57:44,975 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] 2024-05-10T11:57:44,975 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); 2024-05-10T11:57:44,975 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-05-10T11:57:44,981 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 >&)’: 2024-05-10T11:57:44,981 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] 2024-05-10T11:57:44,981 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); 2024-05-10T11:57:44,981 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-05-10T11:58:15,158 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so 2024-05-10T11:58:15,482 building 'moleculekit.distance_utils' extension 2024-05-10T11:58:15,482 creating build/temp.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-05-10T11:58:15,483 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/distance_utils/distance_utils.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.o -O3 2024-05-10T11:58:15,720 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T11:58:15,720 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T11:58:15,720 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T11:58:15,720 from moleculekit/distance_utils/distance_utils.cpp:1265: 2024-05-10T11:58:15,721 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T11:58:15,721 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T11:58:15,721 | ^~~~~~~ 2024-05-10T11:58:17,358 moleculekit/distance_utils/distance_utils.cpp: In function ‘PyObject* __pyx_pf_11moleculekit_14distance_utils_2get_collisions(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, float)’: 2024-05-10T11:58:17,358 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] 2024-05-10T11:58:17,358 21359 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-05-10T11:58:17,359 | ~~~~~~~~~~^~~~~~~~~~~ 2024-05-10T11:58:17,359 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] 2024-05-10T11:58:17,359 21371 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-05-10T11:58:17,359 | ~~~~~~~~~~^~~~~~~~~~~ 2024-05-10T11:58:50,336 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so 2024-05-10T11:58:50,686 building 'moleculekit.occupancy_utils' extension 2024-05-10T11:58:50,687 creating build/temp.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-05-10T11:58:50,687 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/occupancy_utils/occupancy_utils.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.o -O3 2024-05-10T11:58:50,938 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T11:58:50,938 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T11:58:50,938 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T11:58:50,938 from moleculekit/occupancy_utils/occupancy_utils.cpp:1265: 2024-05-10T11:58:50,939 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T11:58:50,939 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T11:58:50,939 | ^~~~~~~ 2024-05-10T11:59:13,979 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so 2024-05-10T11:59:14,193 building 'moleculekit.cython_utils' extension 2024-05-10T11:59:14,194 creating build/temp.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-05-10T11:59:14,195 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/cython_utils/cython_utils.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.o -O3 2024-05-10T11:59:14,425 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T11:59:14,426 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T11:59:14,426 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T11:59:14,426 from moleculekit/cython_utils/cython_utils.cpp:1265: 2024-05-10T11:59:14,426 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T11:59:14,426 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T11:59:14,426 | ^~~~~~~ 2024-05-10T11:59:39,816 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils.cpython-39-arm-linux-gnueabihf.so 2024-05-10T11:59:40,131 building 'moleculekit.xtc' extension 2024-05-10T11:59:40,132 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats 2024-05-10T11:59:40,132 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-05-10T11:59:40,133 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-05-10T11:59:40,134 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/xtc -Imoleculekit/fileformats/xtc/include/ -Imoleculekit/fileformats/xtc/ -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/fileformats/xtc/src/xdrfile.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile.o 2024-05-10T11:59:40,371 moleculekit/fileformats/xtc/src/xdrfile.cpp:66:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,372 66 | "OK", 2024-05-10T11:59:40,372 | ^~~~ 2024-05-10T11:59:40,372 moleculekit/fileformats/xtc/src/xdrfile.cpp:67:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,372 67 | "Header", 2024-05-10T11:59:40,372 | ^~~~~~~~ 2024-05-10T11:59:40,372 moleculekit/fileformats/xtc/src/xdrfile.cpp:68:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,373 68 | "String", 2024-05-10T11:59:40,373 | ^~~~~~~~ 2024-05-10T11:59:40,373 moleculekit/fileformats/xtc/src/xdrfile.cpp:69:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,373 69 | "Double", 2024-05-10T11:59:40,373 | ^~~~~~~~ 2024-05-10T11:59:40,373 moleculekit/fileformats/xtc/src/xdrfile.cpp:70:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,373 70 | "Integer", 2024-05-10T11:59:40,374 | ^~~~~~~~~ 2024-05-10T11:59:40,374 moleculekit/fileformats/xtc/src/xdrfile.cpp:71:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,374 71 | "Float", 2024-05-10T11:59:40,374 | ^~~~~~~ 2024-05-10T11:59:40,374 moleculekit/fileformats/xtc/src/xdrfile.cpp:72:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,374 72 | "Unsigned integer", 2024-05-10T11:59:40,374 | ^~~~~~~~~~~~~~~~~~ 2024-05-10T11:59:40,374 moleculekit/fileformats/xtc/src/xdrfile.cpp:73:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,375 73 | "Compressed 3D coordinate", 2024-05-10T11:59:40,375 | ^~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T11:59:40,375 moleculekit/fileformats/xtc/src/xdrfile.cpp:74:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,375 74 | "Closing file", 2024-05-10T11:59:40,375 | ^~~~~~~~~~~~~~ 2024-05-10T11:59:40,375 moleculekit/fileformats/xtc/src/xdrfile.cpp:75:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,375 75 | "Magic number", 2024-05-10T11:59:40,376 | ^~~~~~~~~~~~~~ 2024-05-10T11:59:40,376 moleculekit/fileformats/xtc/src/xdrfile.cpp:76:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,376 76 | "Not enough memory", 2024-05-10T11:59:40,376 | ^~~~~~~~~~~~~~~~~~~ 2024-05-10T11:59:40,376 moleculekit/fileformats/xtc/src/xdrfile.cpp:77:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,376 77 | "End of file", 2024-05-10T11:59:40,376 | ^~~~~~~~~~~~~ 2024-05-10T11:59:40,377 moleculekit/fileformats/xtc/src/xdrfile.cpp:78:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-05-10T11:59:40,377 78 | "File not found" 2024-05-10T11:59:40,377 | ^~~~~~~~~~~~~~~~ 2024-05-10T11:59:40,381 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofint(int)’: 2024-05-10T11:59:40,381 moleculekit/fileformats/xtc/src/xdrfile.cpp:459:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,381 459 | while (size >= num && num_of_bits < 32) 2024-05-10T11:59:40,381 | ~~~~~^~~~~~ 2024-05-10T11:59:40,382 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-05-10T11:59:40,382 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T11:59:40,382 505 | while (bytes[num_of_bytes] >= num) 2024-05-10T11:59:40,382 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-05-10T11:59:40,384 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-05-10T11:59:40,384 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,384 614 | if (num_of_bits >= num_of_bytes * 8) 2024-05-10T11:59:40,384 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-05-10T11:59:40,385 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,385 616 | for (i = 0; i < num_of_bytes; i++) 2024-05-10T11:59:40,385 | ~~^~~~~~~~~~~~~~ 2024-05-10T11:59:40,385 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,385 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-05-10T11:59:40,385 | ~~^~~~~~~~~~~~~~~~ 2024-05-10T11:59:40,386 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-05-10T11:59:40,386 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:16: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T11:59:40,386 664 | if (lastbits < num_of_bits) 2024-05-10T11:59:40,386 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-05-10T11:59:40,389 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-05-10T11:59:40,389 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T11:59:40,390 785 | if(size3>xfp->buf1size) 2024-05-10T11:59:40,390 | ~~~~~^~~~~~~~~~~~~~ 2024-05-10T11:59:40,391 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T11:59:40,391 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-05-10T11:59:40,394 | ~~~~~~~~~^~~~~~~~ 2024-05-10T11:59:40,394 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,394 935 | if(countmjh >= size3 ) { return -1; } 2024-05-10T11:59:40,395 | ~~~~~~~~~^~~~~~~~ 2024-05-10T11:59:40,395 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,395 938 | if(countmjh >= size3 ) { return -1; } 2024-05-10T11:59:40,395 | ~~~~~~~~~^~~~~~~~ 2024-05-10T11:59:40,395 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,395 945 | if(countmjh >= size3 ) { return -1; } 2024-05-10T11:59:40,395 | ~~~~~~~~~^~~~~~~~ 2024-05-10T11:59:40,395 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,396 948 | if(countmjh >= size3 ) { return -1; } 2024-05-10T11:59:40,396 | ~~~~~~~~~^~~~~~~~ 2024-05-10T11:59:40,396 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,396 951 | if(countmjh >= size3 ) { return -1; } 2024-05-10T11:59:40,396 | ~~~~~~~~~^~~~~~~~ 2024-05-10T11:59:40,396 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:17: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-05-10T11:59:40,396 756 | int smallidx, minidx, maxidx; 2024-05-10T11:59:40,397 | ^~~~~~ 2024-05-10T11:59:40,397 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:25: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-05-10T11:59:40,397 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-05-10T11:59:40,397 | ^~~~~~ 2024-05-10T11:59:40,397 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:6: warning: unused variable ‘errval’ [-Wunused-variable] 2024-05-10T11:59:40,397 763 | int errval=1; 2024-05-10T11:59:40,397 | ^~~~~~ 2024-05-10T11:59:40,398 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-05-10T11:59:40,398 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T11:59:40,398 1011 | if(size3>xfp->buf1size) 2024-05-10T11:59:40,399 | ~~~~~^~~~~~~~~~~~~~ 2024-05-10T11:59:40,400 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:29: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,400 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-05-10T11:59:40,401 | ~~~~~~~~^~~~~~~ 2024-05-10T11:59:40,401 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,401 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-05-10T11:59:40,401 | ~~~~~~~~^~~~~~~ 2024-05-10T11:59:40,402 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,402 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-05-10T11:59:40,402 | ~~~~~~~~^~~~~~~ 2024-05-10T11:59:40,403 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,403 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-05-10T11:59:40,403 | ^ 2024-05-10T11:59:40,404 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T11:59:40,404 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-05-10T11:59:40,411 | ~~~~~^~~~~~~~~~~~~~ 2024-05-10T11:59:40,413 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T11:59:40,413 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-05-10T11:59:40,418 | ~~~~~^~~~~~~~~~~~~~ 2024-05-10T11:59:40,422 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T11:59:40,422 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-05-10T11:59:40,422 | ^ 2024-05-10T11:59:40,423 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T11:59:40,423 1633 | maxidx = (LASTIDX= num && num_of_bits < 32) 2024-05-10T12:00:05,260 | ~~~~~^~~~~~ 2024-05-10T12:00:05,260 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-05-10T12:00:05,260 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:00:05,261 505 | while (bytes[num_of_bytes] >= num) 2024-05-10T12:00:05,261 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-05-10T12:00:05,263 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-05-10T12:00:05,263 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,263 614 | if (num_of_bits >= num_of_bytes * 8) 2024-05-10T12:00:05,263 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-05-10T12:00:05,263 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,264 616 | for (i = 0; i < num_of_bytes; i++) 2024-05-10T12:00:05,264 | ~~^~~~~~~~~~~~~~ 2024-05-10T12:00:05,264 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,264 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-05-10T12:00:05,264 | ~~^~~~~~~~~~~~~~~~ 2024-05-10T12:00:05,264 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-05-10T12:00:05,264 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:16: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:00:05,264 664 | if (lastbits < num_of_bits) 2024-05-10T12:00:05,265 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-05-10T12:00:05,268 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-05-10T12:00:05,268 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:00:05,268 785 | if(size3>xfp->buf1size) 2024-05-10T12:00:05,268 | ~~~~~^~~~~~~~~~~~~~ 2024-05-10T12:00:05,270 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:00:05,270 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-05-10T12:00:05,273 | ~~~~~~~~~^~~~~~~~ 2024-05-10T12:00:05,273 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,273 935 | if(countmjh >= size3 ) { return -1; } 2024-05-10T12:00:05,273 | ~~~~~~~~~^~~~~~~~ 2024-05-10T12:00:05,273 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,274 938 | if(countmjh >= size3 ) { return -1; } 2024-05-10T12:00:05,274 | ~~~~~~~~~^~~~~~~~ 2024-05-10T12:00:05,274 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,274 945 | if(countmjh >= size3 ) { return -1; } 2024-05-10T12:00:05,274 | ~~~~~~~~~^~~~~~~~ 2024-05-10T12:00:05,274 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,274 948 | if(countmjh >= size3 ) { return -1; } 2024-05-10T12:00:05,274 | ~~~~~~~~~^~~~~~~~ 2024-05-10T12:00:05,275 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,275 951 | if(countmjh >= size3 ) { return -1; } 2024-05-10T12:00:05,275 | ~~~~~~~~~^~~~~~~~ 2024-05-10T12:00:05,275 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:17: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-05-10T12:00:05,275 756 | int smallidx, minidx, maxidx; 2024-05-10T12:00:05,275 | ^~~~~~ 2024-05-10T12:00:05,275 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:25: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-05-10T12:00:05,275 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-05-10T12:00:05,276 | ^~~~~~ 2024-05-10T12:00:05,276 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:6: warning: unused variable ‘errval’ [-Wunused-variable] 2024-05-10T12:00:05,276 763 | int errval=1; 2024-05-10T12:00:05,276 | ^~~~~~ 2024-05-10T12:00:05,277 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-05-10T12:00:05,277 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:00:05,277 1011 | if(size3>xfp->buf1size) 2024-05-10T12:00:05,277 | ~~~~~^~~~~~~~~~~~~~ 2024-05-10T12:00:05,279 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:29: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,279 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-05-10T12:00:05,279 | ~~~~~~~~^~~~~~~ 2024-05-10T12:00:05,280 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,280 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-05-10T12:00:05,280 | ~~~~~~~~^~~~~~~ 2024-05-10T12:00:05,280 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,280 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-05-10T12:00:05,280 | ~~~~~~~~^~~~~~~ 2024-05-10T12:00:05,282 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,282 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-05-10T12:00:05,282 | ^ 2024-05-10T12:00:05,282 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:00:05,282 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-05-10T12:00:05,290 | ~~~~~^~~~~~~~~~~~~~ 2024-05-10T12:00:05,291 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:00:05,291 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-05-10T12:00:05,297 | ~~~~~^~~~~~~~~~~~~~ 2024-05-10T12:00:05,301 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:00:05,301 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-05-10T12:00:05,301 | ^ 2024-05-10T12:00:05,301 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:00:05,301 1633 | maxidx = (LASTIDX= __pyx_pybuffernd_forces.diminfo[2].shape)) __pyx_t_4 = 2; 2024-05-10T12:00:39,998 | ^ 2024-05-10T12:00:40,005 moleculekit/fileformats/xtc/trr.c:11555:19: warning: ‘__pyx_pybuffernd_forces.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,005 11555 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_forces.diminfo[1].shape)) __pyx_t_4 = 1; 2024-05-10T12:00:40,005 | ^ 2024-05-10T12:00:40,006 moleculekit/fileformats/xtc/trr.c:2509:95: warning: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,006 2509 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-05-10T12:00:40,006 | ^ 2024-05-10T12:00:40,011 moleculekit/fileformats/xtc/trr.c:10091:21: note: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ was declared here 2024-05-10T12:00:40,012 10091 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-05-10T12:00:40,012 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-05-10T12:00:40,018 moleculekit/fileformats/xtc/trr.c:11549:59: warning: ‘__pyx_pybuffernd_forces.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,018 11549 | __pyx_t_28 += __pyx_pybuffernd_forces.diminfo[0].shape; 2024-05-10T12:00:40,018 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-05-10T12:00:40,024 moleculekit/fileformats/xtc/trr.c:11502:19: warning: ‘__pyx_pybuffernd_vel.diminfo[2].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,025 11502 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_vel.diminfo[2].shape)) __pyx_t_4 = 2; 2024-05-10T12:00:40,025 | ^ 2024-05-10T12:00:40,031 moleculekit/fileformats/xtc/trr.c:11498:19: warning: ‘__pyx_pybuffernd_vel.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,032 11498 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_vel.diminfo[1].shape)) __pyx_t_4 = 1; 2024-05-10T12:00:40,032 | ^ 2024-05-10T12:00:40,032 moleculekit/fileformats/xtc/trr.c:2509:95: warning: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,033 2509 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-05-10T12:00:40,033 | ^ 2024-05-10T12:00:40,038 moleculekit/fileformats/xtc/trr.c:10107:21: note: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ was declared here 2024-05-10T12:00:40,038 10107 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-05-10T12:00:40,039 | ^~~~~~~~~~~~~~~~~~~~ 2024-05-10T12:00:40,044 moleculekit/fileformats/xtc/trr.c:11492:56: warning: ‘__pyx_pybuffernd_vel.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,044 11492 | __pyx_t_28 += __pyx_pybuffernd_vel.diminfo[0].shape; 2024-05-10T12:00:40,045 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-05-10T12:00:40,050 moleculekit/fileformats/xtc/trr.c:11891:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,050 11891 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_xyz_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-05-10T12:00:40,051 | ^ 2024-05-10T12:00:40,057 moleculekit/fileformats/xtc/trr.c:11887:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,058 11887 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_xyz_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-05-10T12:00:40,058 | ^ 2024-05-10T12:00:40,064 moleculekit/fileformats/xtc/trr.c:11732:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,065 11732 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_vel_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-05-10T12:00:40,065 | ^ 2024-05-10T12:00:40,071 moleculekit/fileformats/xtc/trr.c:11728:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,072 11728 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_vel_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-05-10T12:00:40,072 | ^ 2024-05-10T12:00:40,077 moleculekit/fileformats/xtc/trr.c:11784:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,078 11784 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_forces_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-05-10T12:00:40,078 | ^ 2024-05-10T12:00:40,085 moleculekit/fileformats/xtc/trr.c:11780:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:00:40,085 11780 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_forces_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-05-10T12:00:40,085 | ^ 2024-05-10T12:00:46,572 arm-linux-gnueabihf-gcc -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdr_seek.o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile.o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile_trr.o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trr.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/trr.cpython-39-arm-linux-gnueabihf.so 2024-05-10T12:00:46,765 building 'moleculekit.dcd' extension 2024-05-10T12:00:46,766 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-05-10T12:00:46,767 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-05-10T12:00:46,768 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/dcd -Imoleculekit/fileformats/dcd/include/ -Imoleculekit/fileformats/dcd/ -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/fileformats/dcd/dcd.c -o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.o 2024-05-10T12:00:47,091 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T12:00:47,092 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T12:00:47,092 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T12:00:47,092 from moleculekit/fileformats/dcd/dcd.c:1256: 2024-05-10T12:00:47,092 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T12:00:47,092 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T12:00:47,092 | ^~~~~~~ 2024-05-10T12:00:48,125 In file included from moleculekit/fileformats/dcd/include/dcdplugin.h:1, 2024-05-10T12:00:48,125 from moleculekit/fileformats/dcd/dcd.c:1262: 2024-05-10T12:00:48,125 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-05-10T12:00:48,125 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-05-10T12:00:48,126 | ^~~~~~~~~~~~~ 2024-05-10T12:00:48,126 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-05-10T12:00:48,126 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-05-10T12:00:48,126 | ^~~~~~~~~~~~~~ 2024-05-10T12:00:48,126 moleculekit/fileformats/dcd/include/fastio.h:466:12: warning: ‘fio_write_int32’ defined but not used [-Wunused-function] 2024-05-10T12:00:48,126 466 | static int fio_write_int32(fio_fd fd, int i) { 2024-05-10T12:00:48,126 | ^~~~~~~~~~~~~~~ 2024-05-10T12:00:48,127 moleculekit/fileformats/dcd/include/fastio.h:457:19: warning: ‘fio_ftell’ defined but not used [-Wunused-function] 2024-05-10T12:00:48,127 457 | static fio_size_t fio_ftell(fio_fd fd) { 2024-05-10T12:00:48,127 | ^~~~~~~~~ 2024-05-10T12:00:48,127 moleculekit/fileformats/dcd/include/fastio.h:450:19: warning: ‘fio_fseek’ defined but not used [-Wunused-function] 2024-05-10T12:00:48,127 450 | static fio_size_t fio_fseek(fio_fd fd, fio_size_t offset, int whence) { 2024-05-10T12:00:48,127 | ^~~~~~~~~ 2024-05-10T12:00:48,127 moleculekit/fileformats/dcd/include/fastio.h:415:19: warning: ‘fio_readv’ defined but not used [-Wunused-function] 2024-05-10T12:00:48,128 415 | static fio_size_t fio_readv(fio_fd fd, const fio_iovec * iov, int iovcnt) { 2024-05-10T12:00:48,128 | ^~~~~~~~~ 2024-05-10T12:00:48,128 moleculekit/fileformats/dcd/include/fastio.h:394:12: warning: ‘fio_fclose’ defined but not used [-Wunused-function] 2024-05-10T12:00:48,128 394 | static int fio_fclose(fio_fd fd) { 2024-05-10T12:00:48,128 | ^~~~~~~~~~ 2024-05-10T12:00:48,128 moleculekit/fileformats/dcd/include/fastio.h:366:12: warning: ‘fio_open’ defined but not used [-Wunused-function] 2024-05-10T12:00:48,128 366 | static int fio_open(const char *filename, int mode, fio_fd *fd) { 2024-05-10T12:00:48,128 | ^~~~~~~~ 2024-05-10T12:01:00,762 moleculekit/fileformats/dcd/dcd.c: In function ‘__pyx_pf_11moleculekit_3dcd_17DCDTrajectoryFile_18read’: 2024-05-10T12:01:00,762 moleculekit/fileformats/dcd/dcd.c:1158:40: warning: ‘__pyx_v_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:01:00,762 1158 | #define PyInt_FromLong PyLong_FromLong 2024-05-10T12:01:00,763 | ^~~~~~~~~~~~~~~ 2024-05-10T12:01:00,767 moleculekit/fileformats/dcd/dcd.c:8022:7: note: ‘__pyx_v_i’ was declared here 2024-05-10T12:01:00,767 8022 | int __pyx_v_i; 2024-05-10T12:01:00,767 | ^~~~~~~~~ 2024-05-10T12:01:03,994 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/dcd -Imoleculekit/fileformats/dcd/include/ -Imoleculekit/fileformats/dcd/ -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/fileformats/dcd/src/dcdplugin.c -o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src/dcdplugin.o 2024-05-10T12:01:04,180 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdheader’: 2024-05-10T12:01:04,180 moleculekit/fileformats/dcd/src/dcdplugin.c:150:55: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:01:04,180 150 | else if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-05-10T12:01:04,181 | ^~ 2024-05-10T12:01:04,181 moleculekit/fileformats/dcd/src/dcdplugin.c:173:54: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:01:04,181 173 | if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-05-10T12:01:04,181 | ^~ 2024-05-10T12:01:04,181 moleculekit/fileformats/dcd/src/dcdplugin.c:194:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:01:04,181 194 | if (input_integer[0] != dcdcordmagic) 2024-05-10T12:01:04,182 | ^~ 2024-05-10T12:01:04,184 moleculekit/fileformats/dcd/src/dcdplugin.c:409:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:01:04,185 409 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-05-10T12:01:04,185 | ^~ 2024-05-10T12:01:04,185 moleculekit/fileformats/dcd/src/dcdplugin.c:428:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-05-10T12:01:04,185 428 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-05-10T12:01:04,185 | ^~ 2024-05-10T12:01:04,189 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdstep’: 2024-05-10T12:01:04,189 moleculekit/fileformats/dcd/src/dcdplugin.c:651:23: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:01:04,189 651 | if (tmpbuf[i] != sizeof(float) * N) 2024-05-10T12:01:04,189 | ^~ 2024-05-10T12:01:04,190 moleculekit/fileformats/dcd/src/dcdplugin.c:659:49: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-05-10T12:01:04,190 659 | if ((tmpbuf[2 * i] + tmpbuf[2 * i + 1]) != sizeof(float) * N) 2024-05-10T12:01:04,190 | ^~ 2024-05-10T12:01:04,212 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:55: 2024-05-10T12:01:04,212 At top level: 2024-05-10T12:01:04,213 moleculekit/fileformats/dcd/include/endianswap.h:96:13: warning: ‘swap2_aligned’ defined but not used [-Wunused-function] 2024-05-10T12:01:04,213 96 | static void swap2_aligned(void *v, long ndata) { 2024-05-10T12:01:04,213 | ^~~~~~~~~~~~~ 2024-05-10T12:01:04,213 moleculekit/fileformats/dcd/include/endianswap.h:32:13: warning: ‘swap2_unaligned’ defined but not used [-Wunused-function] 2024-05-10T12:01:04,213 32 | static void swap2_unaligned(void *v, long ndata) { 2024-05-10T12:01:04,213 | ^~~~~~~~~~~~~~~ 2024-05-10T12:01:04,213 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:46: 2024-05-10T12:01:04,214 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-05-10T12:01:04,214 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-05-10T12:01:04,214 | ^~~~~~~~~~~~~ 2024-05-10T12:01:04,214 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-05-10T12:01:04,214 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-05-10T12:01:04,214 | ^~~~~~~~~~~~~~ 2024-05-10T12:01:05,317 arm-linux-gnueabihf-gcc -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src/dcdplugin.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/dcd.cpython-39-arm-linux-gnueabihf.so 2024-05-10T12:01:05,466 building 'moleculekit.binpos' extension 2024-05-10T12:01:05,467 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-05-10T12:01:05,469 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-05-10T12:01:05,470 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/binpos -Imoleculekit/fileformats/binpos/include/ -Imoleculekit/fileformats/binpos/ -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/fileformats/binpos/binpos.c -o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.o 2024-05-10T12:01:05,801 In file included from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2024-05-10T12:01:05,801 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2024-05-10T12:01:05,802 from /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/arrayobject.h:5, 2024-05-10T12:01:05,802 from moleculekit/fileformats/binpos/binpos.c:1256: 2024-05-10T12:01:05,802 /tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2024-05-10T12:01:05,802 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-05-10T12:01:05,802 | ^~~~~~~ 2024-05-10T12:01:19,270 moleculekit/fileformats/binpos/binpos.c: In function ‘__pyx_pw_11moleculekit_6binpos_20BINPOSTrajectoryFile_7_read’: 2024-05-10T12:01:19,274 moleculekit/fileformats/binpos/binpos.c:8045:6: warning: ‘__pyx_v_status’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:01:19,274 8045 | if (__pyx_t_1) { 2024-05-10T12:01:19,275 | ^ 2024-05-10T12:01:19,278 moleculekit/fileformats/binpos/binpos.c:7522:7: note: ‘__pyx_v_status’ was declared here 2024-05-10T12:01:19,279 7522 | int __pyx_v_status; 2024-05-10T12:01:19,279 | ^~~~~~~~~~~~~~ 2024-05-10T12:01:19,279 moleculekit/fileformats/binpos/binpos.c:1158:40: warning: ‘__pyx_v_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-05-10T12:01:19,279 1158 | #define PyInt_FromLong PyLong_FromLong 2024-05-10T12:01:19,279 | ^~~~~~~~~~~~~~~ 2024-05-10T12:01:19,283 moleculekit/fileformats/binpos/binpos.c:7519:7: note: ‘__pyx_v_i’ was declared here 2024-05-10T12:01:19,284 7519 | int __pyx_v_i; 2024-05-10T12:01:19,284 | ^~~~~~~~~ 2024-05-10T12:01:21,520 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/fileformats/binpos -Imoleculekit/fileformats/binpos/include/ -Imoleculekit/fileformats/binpos/ -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/fileformats/binpos/src/binposplugin.c -o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src/binposplugin.o 2024-05-10T12:01:21,818 arm-linux-gnueabihf-gcc -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.o build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src/binposplugin.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/binpos.cpython-39-arm-linux-gnueabihf.so 2024-05-10T12:01:21,951 building 'moleculekit.tmalign' extension 2024-05-10T12:01:21,952 creating build/temp.linux-armv7l-cpython-39/moleculekit/tmalign 2024-05-10T12:01:21,953 creating build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-05-10T12:01:21,954 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/tmalign -Imoleculekit/tmalign/include/ -Imoleculekit/tmalign/ -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/tmalign/src/TMAlign.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/src/TMAlign.o -w 2024-05-10T12:01:51,340 arm-linux-gnueabihf-gcc -pthread -Wno-unused-result -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -ffile-prefix-map=/python3.9-3.9.2=. -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -Imoleculekit/tmalign -Imoleculekit/tmalign/include/ -Imoleculekit/tmalign/ -I/tmp/pip-build-env-ffgqyra7/overlay/lib/python3.9/site-packages/numpy/core/include -I/usr/include/python3.9 -c moleculekit/tmalign/tmalign_util.cpp -o build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.o -w 2024-05-10T12:02:09,772 In file included from /usr/include/c++/10/vector:72, 2024-05-10T12:02:09,773 from moleculekit/tmalign/tmalign_util.cpp:1280: 2024-05-10T12:02:09,773 /usr/include/c++/10/bits/vector.tcc: In member function ‘void std::vector<_Tp, _Alloc>::_M_realloc_insert(std::vector<_Tp, _Alloc>::iterator, _Args&& ...) [with _Args = {const double&}; _Tp = double; _Alloc = std::allocator]’: 2024-05-10T12:02:09,773 /usr/include/c++/10/bits/vector.tcc:426:7: note: parameter passing for argument of type ‘std::vector::iterator’ changed in GCC 7.1 2024-05-10T12:02:09,773 426 | vector<_Tp, _Alloc>:: 2024-05-10T12:02:09,773 | ^~~~~~~~~~~~~~~~~~~ 2024-05-10T12:02:10,351 In file included from /usr/include/c++/10/vector:67, 2024-05-10T12:02:10,352 from moleculekit/tmalign/tmalign_util.cpp:1280: 2024-05-10T12:02:10,352 /usr/include/c++/10/bits/stl_vector.h: In function ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-05-10T12:02:10,352 /usr/include/c++/10/bits/stl_vector.h:1198:21: note: parameter passing for argument of type ‘__gnu_cxx::__normal_iterator >’ changed in GCC 7.1 2024-05-10T12:02:10,352 1198 | _M_realloc_insert(end(), __x); 2024-05-10T12:02:10,352 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-05-10T12:02:10,352 /usr/include/c++/10/bits/stl_vector.h:1198:21: note: parameter passing for argument of type ‘__gnu_cxx::__normal_iterator >’ changed in GCC 7.1 2024-05-10T12:02:10,353 1198 | _M_realloc_insert(end(), __x); 2024-05-10T12:02:10,353 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-05-10T12:02:10,353 /usr/include/c++/10/bits/stl_vector.h:1198:21: note: parameter passing for argument of type ‘__gnu_cxx::__normal_iterator >’ changed in GCC 7.1 2024-05-10T12:02:10,353 1198 | _M_realloc_insert(end(), __x); 2024-05-10T12:02:10,354 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-05-10T12:02:12,821 arm-linux-gnueabihf-g++ -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -g -fwrapv -O2 build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/src/TMAlign.o build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.o -L/usr/lib -o build/lib.linux-armv7l-cpython-39/moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so 2024-05-10T12:02:13,273 UPDATING build/lib.linux-armv7l-cpython-39/moleculekit/_version.py 2024-05-10T12:02:13,274 set build/lib.linux-armv7l-cpython-39/moleculekit/_version.py to '1.8.32' 2024-05-10T12:02:13,274 installing to build/bdist.linux-armv7l/wheel 2024-05-10T12:02:13,274 running install 2024-05-10T12:02:13,300 running install_lib 2024-05-10T12:02:13,306 creating build/bdist.linux-armv7l 2024-05-10T12:02:13,307 creating build/bdist.linux-armv7l/wheel 2024-05-10T12:02:13,309 creating build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,310 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,329 creating build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-05-10T12:02:13,330 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/yacc.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-05-10T12:02:13,334 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/lex.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-05-10T12:02:13,337 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-05-10T12:02:13,339 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-05-10T12:02:13,341 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-05-10T12:02:13,343 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-05-10T12:02:13,347 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-05-10T12:02:13,350 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-05-10T12:02:13,351 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/restrainedembed.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-05-10T12:02:13,353 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/clustering.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-05-10T12:02:13,356 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/test_tools.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-05-10T12:02:13,358 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-05-10T12:02:13,361 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmolcdp.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-05-10T12:02:13,363 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/test_smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-05-10T12:02:13,366 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/test_smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-05-10T12:02:13,368 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-05-10T12:02:13,370 copying build/lib.linux-armv7l-cpython-39/moleculekit/viewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,373 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,395 copying build/lib.linux-armv7l-cpython-39/moleculekit/align.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,398 copying build/lib.linux-armv7l-cpython-39/moleculekit/readers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,403 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-05-10T12:02:13,404 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/atomselect.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-05-10T12:02:13,407 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/languageparser.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-05-10T12:02:13,409 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/analyze.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-05-10T12:02:13,412 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-05-10T12:02:13,414 creating build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-05-10T12:02:13,415 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-05-10T12:02:13,448 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-05-10T12:02:13,451 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,453 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-05-10T12:02:13,454 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/utils.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-05-10T12:02:13,457 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-05-10T12:02:13,458 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtclib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-05-10T12:02:13,460 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-05-10T12:02:13,479 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-05-10T12:02:13,481 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-05-10T12:02:13,503 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trr.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-05-10T12:02:13,506 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-05-10T12:02:13,506 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-05-10T12:02:13,509 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdr_seek.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-05-10T12:02:13,511 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-05-10T12:02:13,513 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-05-10T12:02:13,516 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-05-10T12:02:13,517 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xdrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-05-10T12:02:13,520 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-05-10T12:02:13,520 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-05-10T12:02:13,522 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-05-10T12:02:13,524 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-05-10T12:02:13,526 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-05-10T12:02:13,528 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/trr_header.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-05-10T12:02:13,530 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdr_seek.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-05-10T12:02:13,531 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtc.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-05-10T12:02:13,533 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-05-10T12:02:13,534 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-05-10T12:02:13,537 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-05-10T12:02:13,557 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-05-10T12:02:13,558 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src/dcdplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-05-10T12:02:13,562 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-05-10T12:02:13,562 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-05-10T12:02:13,565 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/endianswap.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-05-10T12:02:13,567 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-05-10T12:02:13,569 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/fastio.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-05-10T12:02:13,571 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/dcdplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-05-10T12:02:13,573 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcdlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-05-10T12:02:13,575 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-05-10T12:02:13,576 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-05-10T12:02:13,578 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binposlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-05-10T12:02:13,580 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-05-10T12:02:13,581 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src/binposplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-05-10T12:02:13,584 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-05-10T12:02:13,585 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-05-10T12:02:13,588 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-05-10T12:02:13,589 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/binposplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-05-10T12:02:13,591 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-05-10T12:02:13,610 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/netcdf.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-05-10T12:02:13,612 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-05-10T12:02:13,614 copying build/lib.linux-armv7l-cpython-39/moleculekit/logging.ini -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,616 creating build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-05-10T12:02:13,617 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-05-10T12:02:13,644 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-05-10T12:02:13,646 copying build/lib.linux-armv7l-cpython-39/moleculekit/util.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,648 copying build/lib.linux-armv7l-cpython-39/moleculekit/config.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,650 copying build/lib.linux-armv7l-cpython-39/moleculekit/binpos.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,663 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-05-10T12:02:13,665 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-05-10T12:02:13,687 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-05-10T12:02:13,688 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-05-10T12:02:13,690 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-05-10T12:02:13,709 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-05-10T12:02:13,738 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/interactions.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-05-10T12:02:13,742 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-05-10T12:02:13,743 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-05-10T12:02:13,765 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-05-10T12:02:13,767 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-05-10T12:02:13,768 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-05-10T12:02:13,788 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-05-10T12:02:13,791 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-05-10T12:02:13,814 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-05-10T12:02:13,815 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-05-10T12:02:13,834 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-05-10T12:02:13,837 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-05-10T12:02:13,859 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-05-10T12:02:13,861 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmdviewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:13,864 creating build/bdist.linux-armv7l/wheel/moleculekit/share 2024-05-10T12:02:13,865 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr 2024-05-10T12:02:13,869 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,870 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/.gitkeep -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,871 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,873 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,875 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TRO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,877 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BTK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,879 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,880 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,882 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,884 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ORM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,886 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,888 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,889 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2AS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,891 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/5JP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,893 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,895 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/KYN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,897 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BTK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,899 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DA2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,901 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4IN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,903 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2AS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,905 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,906 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AA4.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,908 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HHK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,910 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CGU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,912 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,913 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,915 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,917 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,918 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/P1L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,921 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,922 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BB8.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,924 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,926 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,927 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,929 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2ML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,931 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/I2M.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,932 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,934 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,936 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0AF.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,938 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/SEP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,939 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/D4P.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,941 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0A1.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,943 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HYP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,945 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,946 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/5JP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,948 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MMO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,950 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,952 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,953 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PCA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,955 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ABA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,957 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DPP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,959 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,960 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/M3L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,962 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,964 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OMX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,965 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,967 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ONL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,969 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DA2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,971 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,972 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2MR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,974 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,976 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TPO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,978 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2MR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,979 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/FGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,981 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ESC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,983 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TY2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,985 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0BN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,986 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CGU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,988 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,989 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ORM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,991 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YCM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,993 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4IN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,994 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAB.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,996 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:13,998 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,000 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,002 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,003 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PRK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,006 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HQA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,007 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,009 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2GX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,011 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GNC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,012 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,014 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ESC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,016 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/004.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,018 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,019 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NAL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,021 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,023 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2GX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,025 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PRK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,027 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/FGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,029 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,030 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,032 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GHG.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,034 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,036 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NZC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,037 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PCA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,039 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/APD.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,041 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0AF.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,043 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/I2M.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,044 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,046 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,049 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,050 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,052 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,054 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AA4.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,056 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/APD.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,058 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AHP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,060 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MMO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,062 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,064 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/SEP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,065 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/P1L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,067 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,069 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,070 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/004.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,072 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HOX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,074 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ABA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,075 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,077 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/1MH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,079 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,081 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,082 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DPP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,084 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/KYN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,086 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BB8.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,087 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,090 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/M3L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,092 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NZC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,094 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,096 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,098 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YCM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,100 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YNM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,102 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,103 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/03Y.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,105 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,107 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HPE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,109 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,110 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GHG.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,112 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,114 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/03Y.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,115 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YNM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,117 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IIL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,119 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/1MH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,121 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,122 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IIL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,124 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OMX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,126 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HOX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,128 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HPE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,129 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ME0.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,131 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,133 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ONL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,135 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,137 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0A1.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,139 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GNC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,141 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ME0.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,144 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0BN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,146 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NAL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,147 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,149 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HHK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,151 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TY2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,153 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HQA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,154 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,156 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HYP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,158 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,159 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAB.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,161 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,163 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,164 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/D4P.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,166 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,168 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,169 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TRO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,171 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2ML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,173 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,174 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,176 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,178 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TPO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,180 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AHP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-05-10T12:02:14,182 creating build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-05-10T12:02:14,183 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect/atomselect.json -> build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-05-10T12:02:14,185 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/backbone.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-05-10T12:02:14,186 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/opm_sequences.json -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-05-10T12:02:14,376 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/ALA.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-05-10T12:02:14,378 copying build/lib.linux-armv7l-cpython-39/moleculekit/molecule.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,382 copying build/lib.linux-armv7l-cpython-39/moleculekit/dihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,384 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmdgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,386 creating build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,387 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/voxeldescriptors.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,390 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/crystalpacking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,392 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/hhblitsprofile.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,394 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/preparation_customres.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,396 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/detect.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,399 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/graphalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,401 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/modelling.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,404 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/moleculechecks.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,407 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/preparation.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,410 creating build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-05-10T12:02:14,411 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools/obabel_cli.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-05-10T12:02:14,412 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-05-10T12:02:14,414 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/atomtyper.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,416 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/docking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,418 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/sequencestructuralalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,420 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/autosegment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,422 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-05-10T12:02:14,424 creating build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-05-10T12:02:14,425 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-05-10T12:02:14,427 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-05-10T12:02:14,453 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmd_wrapper -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,455 copying build/lib.linux-armv7l-cpython-39/moleculekit/home.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,456 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,480 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-05-10T12:02:14,481 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-05-10T12:02:14,504 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-05-10T12:02:14,506 copying build/lib.linux-armv7l-cpython-39/moleculekit/rdkitintegration.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,508 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-05-10T12:02:14,509 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-05-10T12:02:14,510 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxWriterTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-05-10T12:02:14,512 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-05-10T12:02:14,515 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxReaderTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-05-10T12:02:14,517 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-05-10T12:02:14,519 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-05-10T12:02:14,520 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer/PdbxWriter.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-05-10T12:02:14,522 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-05-10T12:02:14,524 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-05-10T12:02:14,525 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxContainers.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-05-10T12:02:14,527 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxReader.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-05-10T12:02:14,530 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxParser.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-05-10T12:02:14,533 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-05-10T12:02:14,534 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-05-10T12:02:14,536 copying build/lib.linux-armv7l-cpython-39/moleculekit/dcd.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,555 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,558 copying build/lib.linux-armv7l-cpython-39/moleculekit/version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,559 copying build/lib.linux-armv7l-cpython-39/moleculekit/rcsb.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,561 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,618 copying build/lib.linux-armv7l-cpython-39/moleculekit/pymolgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,620 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,649 copying build/lib.linux-armv7l-cpython-39/moleculekit/writers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,652 copying build/lib.linux-armv7l-cpython-39/moleculekit/trr.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,679 copying build/lib.linux-armv7l-cpython-39/moleculekit/_version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,681 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,708 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,730 creating build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-05-10T12:02:14,731 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-05-10T12:02:14,734 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-05-10T12:02:14,752 creating build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-05-10T12:02:14,753 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-05-10T12:02:14,755 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-05-10T12:02:14,773 copying build/lib.linux-armv7l-cpython-39/moleculekit/opm.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,775 copying build/lib.linux-armv7l-cpython-39/moleculekit/periodictable.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,778 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-05-10T12:02:14,779 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalignlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-05-10T12:02:14,781 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-05-10T12:02:14,808 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-05-10T12:02:14,809 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src/TMAlign.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-05-10T12:02:14,814 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-05-10T12:02:14,816 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-05-10T12:02:14,817 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include/TMAlign.h -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-05-10T12:02:14,820 creating build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,821 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsasa.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,823 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricdihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,826 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,828 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricfluctuation.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,830 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/projection.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,832 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricdistance.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,835 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metrictmscore.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,837 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricshell.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,839 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricgyration.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,841 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricrmsd.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,843 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricplumed2.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,845 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsecondarystructure.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,848 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsphericalcoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,850 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metriccoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,852 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-05-10T12:02:14,853 copying build/lib.linux-armv7l-cpython-39/moleculekit/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,855 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-05-10T12:02:14,883 running install_egg_info 2024-05-10T12:02:14,889 Copying moleculekit.egg-info to build/bdist.linux-armv7l/wheel/moleculekit-1.8.32-py3.9.egg-info 2024-05-10T12:02:14,901 running install_scripts 2024-05-10T12:02:14,949 creating build/bdist.linux-armv7l/wheel/moleculekit-1.8.32.dist-info/WHEEL 2024-05-10T12:02:14,953 creating '/tmp/pip-wheel-cngdb13a/.tmp-e77puo9k/moleculekit-1.8.32-cp39-cp39-linux_armv7l.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2024-05-10T12:02:14,956 adding 'moleculekit/__init__.py' 2024-05-10T12:02:14,957 adding 'moleculekit/_version.py' 2024-05-10T12:02:14,959 adding 'moleculekit/align.py' 2024-05-10T12:02:15,269 adding 'moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:15,431 adding 'moleculekit/binpos.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:15,438 adding 'moleculekit/bondguesser.py' 2024-05-10T12:02:15,680 adding 'moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:15,689 adding 'moleculekit/config.py' 2024-05-10T12:02:15,945 adding 'moleculekit/cython_utils.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:16,118 adding 'moleculekit/dcd.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:16,124 adding 'moleculekit/dihedral.py' 2024-05-10T12:02:16,125 adding 'moleculekit/distance.py' 2024-05-10T12:02:16,453 adding 'moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:16,465 adding 'moleculekit/home.py' 2024-05-10T12:02:16,466 adding 'moleculekit/logging.ini' 2024-05-10T12:02:16,480 adding 'moleculekit/molecule.py' 2024-05-10T12:02:16,707 adding 'moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:16,715 adding 'moleculekit/opm.py' 2024-05-10T12:02:16,718 adding 'moleculekit/periodictable.py' 2024-05-10T12:02:16,719 adding 'moleculekit/pymolgraphics.py' 2024-05-10T12:02:16,720 adding 'moleculekit/rcsb.py' 2024-05-10T12:02:16,722 adding 'moleculekit/rdkitintegration.py' 2024-05-10T12:02:16,735 adding 'moleculekit/readers.py' 2024-05-10T12:02:17,337 adding 'moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:17,648 adding 'moleculekit/trr.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:17,660 adding 'moleculekit/util.py' 2024-05-10T12:02:17,662 adding 'moleculekit/version.py' 2024-05-10T12:02:17,663 adding 'moleculekit/viewer.py' 2024-05-10T12:02:17,665 adding 'moleculekit/vmd_wrapper' 2024-05-10T12:02:17,667 adding 'moleculekit/vmdgraphics.py' 2024-05-10T12:02:17,669 adding 'moleculekit/vmdviewer.py' 2024-05-10T12:02:17,921 adding 'moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:17,935 adding 'moleculekit/writers.py' 2024-05-10T12:02:18,202 adding 'moleculekit/xtc.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:18,212 adding 'moleculekit/atomselect/__init__.py' 2024-05-10T12:02:18,213 adding 'moleculekit/atomselect/analyze.py' 2024-05-10T12:02:18,215 adding 'moleculekit/atomselect/atomselect.py' 2024-05-10T12:02:18,217 adding 'moleculekit/atomselect/languageparser.py' 2024-05-10T12:02:18,321 adding 'moleculekit/atomselect_utils/atomselect_utils.cpp' 2024-05-10T12:02:18,332 adding 'moleculekit/atomselect_utils/atomselect_utils.pyx' 2024-05-10T12:02:18,424 adding 'moleculekit/bondguesser_utils/bondguesser_utils.cpp' 2024-05-10T12:02:18,433 adding 'moleculekit/bondguesser_utils/bondguesser_utils.pyx' 2024-05-10T12:02:18,522 adding 'moleculekit/cython_utils/cython_utils.cpp' 2024-05-10T12:02:18,531 adding 'moleculekit/cython_utils/cython_utils.pyx' 2024-05-10T12:02:18,634 adding 'moleculekit/distance_utils/distance_utils.cpp' 2024-05-10T12:02:18,644 adding 'moleculekit/distance_utils/distance_utils.pyx' 2024-05-10T12:02:18,646 adding 'moleculekit/fileformats/__init__.py' 2024-05-10T12:02:18,651 adding 'moleculekit/fileformats/netcdf.py' 2024-05-10T12:02:18,653 adding 'moleculekit/fileformats/utils.py' 2024-05-10T12:02:18,714 adding 'moleculekit/fileformats/binpos/binpos.c' 2024-05-10T12:02:18,721 adding 'moleculekit/fileformats/binpos/binpos.pyx' 2024-05-10T12:02:18,722 adding 'moleculekit/fileformats/binpos/binposlib.pxd' 2024-05-10T12:02:18,724 adding 'moleculekit/fileformats/binpos/include/binposplugin.h' 2024-05-10T12:02:18,725 adding 'moleculekit/fileformats/binpos/include/largefiles.h' 2024-05-10T12:02:18,730 adding 'moleculekit/fileformats/binpos/include/molfile_plugin.h' 2024-05-10T12:02:18,732 adding 'moleculekit/fileformats/binpos/src/binposplugin.c' 2024-05-10T12:02:18,795 adding 'moleculekit/fileformats/dcd/dcd.c' 2024-05-10T12:02:18,803 adding 'moleculekit/fileformats/dcd/dcd.pyx' 2024-05-10T12:02:18,805 adding 'moleculekit/fileformats/dcd/dcdlib.pxd' 2024-05-10T12:02:18,806 adding 'moleculekit/fileformats/dcd/include/dcdplugin.h' 2024-05-10T12:02:18,808 adding 'moleculekit/fileformats/dcd/include/endianswap.h' 2024-05-10T12:02:18,810 adding 'moleculekit/fileformats/dcd/include/fastio.h' 2024-05-10T12:02:18,811 adding 'moleculekit/fileformats/dcd/include/largefiles.h' 2024-05-10T12:02:18,816 adding 'moleculekit/fileformats/dcd/include/molfile_plugin.h' 2024-05-10T12:02:18,822 adding 'moleculekit/fileformats/dcd/src/dcdplugin.c' 2024-05-10T12:02:18,916 adding 'moleculekit/fileformats/xtc/trr.c' 2024-05-10T12:02:18,928 adding 'moleculekit/fileformats/xtc/trr.pyx' 2024-05-10T12:02:18,929 adding 'moleculekit/fileformats/xtc/trrlib.pxd' 2024-05-10T12:02:18,931 adding 'moleculekit/fileformats/xtc/xdrlib.pxd' 2024-05-10T12:02:19,020 adding 'moleculekit/fileformats/xtc/xtc.cpp' 2024-05-10T12:02:19,028 adding 'moleculekit/fileformats/xtc/xtc.pyx' 2024-05-10T12:02:19,029 adding 'moleculekit/fileformats/xtc/xtclib.pxd' 2024-05-10T12:02:19,031 adding 'moleculekit/fileformats/xtc/include/trr_header.h' 2024-05-10T12:02:19,032 adding 'moleculekit/fileformats/xtc/include/xdr_seek.h' 2024-05-10T12:02:19,035 adding 'moleculekit/fileformats/xtc/include/xdrfile.h' 2024-05-10T12:02:19,036 adding 'moleculekit/fileformats/xtc/include/xdrfile_trr.h' 2024-05-10T12:02:19,038 adding 'moleculekit/fileformats/xtc/include/xdrfile_xtc.h' 2024-05-10T12:02:19,039 adding 'moleculekit/fileformats/xtc/include/xtc.h' 2024-05-10T12:02:19,041 adding 'moleculekit/fileformats/xtc/src/xdr_seek.c' 2024-05-10T12:02:19,047 adding 'moleculekit/fileformats/xtc/src/xdrfile.cpp' 2024-05-10T12:02:19,050 adding 'moleculekit/fileformats/xtc/src/xdrfile_trr.c' 2024-05-10T12:02:19,051 adding 'moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp' 2024-05-10T12:02:19,053 adding 'moleculekit/fileformats/xtc/src/xtc.cpp' 2024-05-10T12:02:19,055 adding 'moleculekit/interactions/__init__.py' 2024-05-10T12:02:19,338 adding 'moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:19,607 adding 'moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:19,619 adding 'moleculekit/interactions/interactions.py' 2024-05-10T12:02:19,900 adding 'moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:20,189 adding 'moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so' 2024-05-10T12:02:20,291 adding 'moleculekit/interactions/cationpi/cationpi.cpp' 2024-05-10T12:02:20,300 adding 'moleculekit/interactions/cationpi/cationpi.pyx' 2024-05-10T12:02:20,392 adding 'moleculekit/interactions/hbonds/hbonds.cpp' 2024-05-10T12:02:20,401 adding 'moleculekit/interactions/hbonds/hbonds.pyx' 2024-05-10T12:02:20,493 adding 'moleculekit/interactions/pipi/pipi.cpp' 2024-05-10T12:02:20,502 adding 'moleculekit/interactions/pipi/pipi.pyx' 2024-05-10T12:02:20,595 adding 'moleculekit/interactions/sigmahole/sigmahole.cpp' 2024-05-10T12:02:20,604 adding 'moleculekit/interactions/sigmahole/sigmahole.pyx' 2024-05-10T12:02:20,692 adding 'moleculekit/occupancy_utils/occupancy_utils.cpp' 2024-05-10T12:02:20,700 adding 'moleculekit/occupancy_utils/occupancy_utils.pyx' 2024-05-10T12:02:20,702 adding 'moleculekit/pdbx/__init__.py' 2024-05-10T12:02:20,705 adding 'moleculekit/pdbx/reader/PdbxContainers.py' 2024-05-10T12:02:20,709 adding 'moleculekit/pdbx/reader/PdbxParser.py' 2024-05-10T12:02:20,711 adding 'moleculekit/pdbx/reader/PdbxReader.py' 2024-05-10T12:02:20,712 adding 'moleculekit/pdbx/reader/__init__.py' 2024-05-10T12:02:20,714 adding 'moleculekit/pdbx/tests/PdbxReadWriteTests.py' 2024-05-10T12:02:20,716 adding 'moleculekit/pdbx/tests/PdbxReaderTests.py' 2024-05-10T12:02:20,717 adding 'moleculekit/pdbx/tests/PdbxWriterTests.py' 2024-05-10T12:02:20,718 adding 'moleculekit/pdbx/tests/__init__.py' 2024-05-10T12:02:20,720 adding 'moleculekit/pdbx/writer/PdbxWriter.py' 2024-05-10T12:02:20,721 adding 'moleculekit/pdbx/writer/__init__.py' 2024-05-10T12:02:20,723 adding 'moleculekit/ply/__init__.py' 2024-05-10T12:02:20,727 adding 'moleculekit/ply/lex.py' 2024-05-10T12:02:20,739 adding 'moleculekit/ply/yacc.py' 2024-05-10T12:02:20,741 adding 'moleculekit/projections/__init__.py' 2024-05-10T12:02:20,743 adding 'moleculekit/projections/metriccoordinate.py' 2024-05-10T12:02:20,747 adding 'moleculekit/projections/metricdihedral.py' 2024-05-10T12:02:20,751 adding 'moleculekit/projections/metricdistance.py' 2024-05-10T12:02:20,753 adding 'moleculekit/projections/metricfluctuation.py' 2024-05-10T12:02:20,755 adding 'moleculekit/projections/metricgyration.py' 2024-05-10T12:02:20,758 adding 'moleculekit/projections/metricplumed2.py' 2024-05-10T12:02:20,760 adding 'moleculekit/projections/metricrmsd.py' 2024-05-10T12:02:20,762 adding 'moleculekit/projections/metricsasa.py' 2024-05-10T12:02:20,764 adding 'moleculekit/projections/metricsecondarystructure.py' 2024-05-10T12:02:20,766 adding 'moleculekit/projections/metricshell.py' 2024-05-10T12:02:20,768 adding 'moleculekit/projections/metricsphericalcoordinate.py' 2024-05-10T12:02:20,769 adding 'moleculekit/projections/metrictmscore.py' 2024-05-10T12:02:20,770 adding 'moleculekit/projections/projection.py' 2024-05-10T12:02:20,772 adding 'moleculekit/projections/util.py' 2024-05-10T12:02:20,774 adding 'moleculekit/share/ALA.cif' 2024-05-10T12:02:20,775 adding 'moleculekit/share/backbone.cif' 2024-05-10T12:02:22,089 adding 'moleculekit/share/opm_sequences.json' 2024-05-10T12:02:22,174 adding 'moleculekit/share/atomselect/atomselect.json' 2024-05-10T12:02:22,179 adding 'moleculekit/share/pdb2pqr/residues/.gitkeep' 2024-05-10T12:02:22,180 adding 'moleculekit/share/pdb2pqr/residues/004.dat' 2024-05-10T12:02:22,181 adding 'moleculekit/share/pdb2pqr/residues/004.xml' 2024-05-10T12:02:22,182 adding 'moleculekit/share/pdb2pqr/residues/03Y.dat' 2024-05-10T12:02:22,184 adding 'moleculekit/share/pdb2pqr/residues/03Y.xml' 2024-05-10T12:02:22,185 adding 'moleculekit/share/pdb2pqr/residues/0A1.dat' 2024-05-10T12:02:22,186 adding 'moleculekit/share/pdb2pqr/residues/0A1.xml' 2024-05-10T12:02:22,187 adding 'moleculekit/share/pdb2pqr/residues/0AF.dat' 2024-05-10T12:02:22,189 adding 'moleculekit/share/pdb2pqr/residues/0AF.xml' 2024-05-10T12:02:22,190 adding 'moleculekit/share/pdb2pqr/residues/0BN.dat' 2024-05-10T12:02:22,191 adding 'moleculekit/share/pdb2pqr/residues/0BN.xml' 2024-05-10T12:02:22,192 adding 'moleculekit/share/pdb2pqr/residues/1MH.dat' 2024-05-10T12:02:22,194 adding 'moleculekit/share/pdb2pqr/residues/1MH.xml' 2024-05-10T12:02:22,195 adding 'moleculekit/share/pdb2pqr/residues/2AS.dat' 2024-05-10T12:02:22,196 adding 'moleculekit/share/pdb2pqr/residues/2AS.xml' 2024-05-10T12:02:22,197 adding 'moleculekit/share/pdb2pqr/residues/2GX.dat' 2024-05-10T12:02:22,198 adding 'moleculekit/share/pdb2pqr/residues/2GX.xml' 2024-05-10T12:02:22,200 adding 'moleculekit/share/pdb2pqr/residues/2ML.dat' 2024-05-10T12:02:22,201 adding 'moleculekit/share/pdb2pqr/residues/2ML.xml' 2024-05-10T12:02:22,202 adding 'moleculekit/share/pdb2pqr/residues/2MR.dat' 2024-05-10T12:02:22,204 adding 'moleculekit/share/pdb2pqr/residues/2MR.xml' 2024-05-10T12:02:22,205 adding 'moleculekit/share/pdb2pqr/residues/4IN.dat' 2024-05-10T12:02:22,206 adding 'moleculekit/share/pdb2pqr/residues/4IN.xml' 2024-05-10T12:02:22,207 adding 'moleculekit/share/pdb2pqr/residues/4PH.dat' 2024-05-10T12:02:22,209 adding 'moleculekit/share/pdb2pqr/residues/4PH.xml' 2024-05-10T12:02:22,210 adding 'moleculekit/share/pdb2pqr/residues/4PQ.dat' 2024-05-10T12:02:22,211 adding 'moleculekit/share/pdb2pqr/residues/4PQ.xml' 2024-05-10T12:02:22,212 adding 'moleculekit/share/pdb2pqr/residues/5JP.dat' 2024-05-10T12:02:22,214 adding 'moleculekit/share/pdb2pqr/residues/5JP.xml' 2024-05-10T12:02:22,215 adding 'moleculekit/share/pdb2pqr/residues/AA4.dat' 2024-05-10T12:02:22,216 adding 'moleculekit/share/pdb2pqr/residues/AA4.xml' 2024-05-10T12:02:22,217 adding 'moleculekit/share/pdb2pqr/residues/ABA.dat' 2024-05-10T12:02:22,218 adding 'moleculekit/share/pdb2pqr/residues/ABA.xml' 2024-05-10T12:02:22,220 adding 'moleculekit/share/pdb2pqr/residues/AHP.dat' 2024-05-10T12:02:22,221 adding 'moleculekit/share/pdb2pqr/residues/AHP.xml' 2024-05-10T12:02:22,222 adding 'moleculekit/share/pdb2pqr/residues/ALC.dat' 2024-05-10T12:02:22,223 adding 'moleculekit/share/pdb2pqr/residues/ALC.xml' 2024-05-10T12:02:22,225 adding 'moleculekit/share/pdb2pqr/residues/ALN.dat' 2024-05-10T12:02:22,226 adding 'moleculekit/share/pdb2pqr/residues/ALN.xml' 2024-05-10T12:02:22,227 adding 'moleculekit/share/pdb2pqr/residues/ALY.dat' 2024-05-10T12:02:22,229 adding 'moleculekit/share/pdb2pqr/residues/ALY.xml' 2024-05-10T12:02:22,230 adding 'moleculekit/share/pdb2pqr/residues/APD.dat' 2024-05-10T12:02:22,231 adding 'moleculekit/share/pdb2pqr/residues/APD.xml' 2024-05-10T12:02:22,232 adding 'moleculekit/share/pdb2pqr/residues/BB8.dat' 2024-05-10T12:02:22,234 adding 'moleculekit/share/pdb2pqr/residues/BB8.xml' 2024-05-10T12:02:22,235 adding 'moleculekit/share/pdb2pqr/residues/BCS.dat' 2024-05-10T12:02:22,236 adding 'moleculekit/share/pdb2pqr/residues/BCS.xml' 2024-05-10T12:02:22,237 adding 'moleculekit/share/pdb2pqr/residues/BTK.dat' 2024-05-10T12:02:22,239 adding 'moleculekit/share/pdb2pqr/residues/BTK.xml' 2024-05-10T12:02:22,240 adding 'moleculekit/share/pdb2pqr/residues/CCS.dat' 2024-05-10T12:02:22,241 adding 'moleculekit/share/pdb2pqr/residues/CCS.xml' 2024-05-10T12:02:22,242 adding 'moleculekit/share/pdb2pqr/residues/CGU.dat' 2024-05-10T12:02:22,243 adding 'moleculekit/share/pdb2pqr/residues/CGU.xml' 2024-05-10T12:02:22,245 adding 'moleculekit/share/pdb2pqr/residues/CSA.dat' 2024-05-10T12:02:22,246 adding 'moleculekit/share/pdb2pqr/residues/CSA.xml' 2024-05-10T12:02:22,247 adding 'moleculekit/share/pdb2pqr/residues/CSO.dat' 2024-05-10T12:02:22,248 adding 'moleculekit/share/pdb2pqr/residues/CSO.xml' 2024-05-10T12:02:22,249 adding 'moleculekit/share/pdb2pqr/residues/CSP.dat' 2024-05-10T12:02:22,251 adding 'moleculekit/share/pdb2pqr/residues/CSP.xml' 2024-05-10T12:02:22,252 adding 'moleculekit/share/pdb2pqr/residues/CSS.dat' 2024-05-10T12:02:22,253 adding 'moleculekit/share/pdb2pqr/residues/CSS.xml' 2024-05-10T12:02:22,254 adding 'moleculekit/share/pdb2pqr/residues/D4P.dat' 2024-05-10T12:02:22,255 adding 'moleculekit/share/pdb2pqr/residues/D4P.xml' 2024-05-10T12:02:22,257 adding 'moleculekit/share/pdb2pqr/residues/DA2.dat' 2024-05-10T12:02:22,258 adding 'moleculekit/share/pdb2pqr/residues/DA2.xml' 2024-05-10T12:02:22,259 adding 'moleculekit/share/pdb2pqr/residues/DAB.dat' 2024-05-10T12:02:22,261 adding 'moleculekit/share/pdb2pqr/residues/DAB.xml' 2024-05-10T12:02:22,262 adding 'moleculekit/share/pdb2pqr/residues/DAH.dat' 2024-05-10T12:02:22,263 adding 'moleculekit/share/pdb2pqr/residues/DAH.xml' 2024-05-10T12:02:22,264 adding 'moleculekit/share/pdb2pqr/residues/DPP.dat' 2024-05-10T12:02:22,265 adding 'moleculekit/share/pdb2pqr/residues/DPP.xml' 2024-05-10T12:02:22,266 adding 'moleculekit/share/pdb2pqr/residues/ESC.dat' 2024-05-10T12:02:22,268 adding 'moleculekit/share/pdb2pqr/residues/ESC.xml' 2024-05-10T12:02:22,269 adding 'moleculekit/share/pdb2pqr/residues/FGL.dat' 2024-05-10T12:02:22,270 adding 'moleculekit/share/pdb2pqr/residues/FGL.xml' 2024-05-10T12:02:22,271 adding 'moleculekit/share/pdb2pqr/residues/GHG.dat' 2024-05-10T12:02:22,273 adding 'moleculekit/share/pdb2pqr/residues/GHG.xml' 2024-05-10T12:02:22,274 adding 'moleculekit/share/pdb2pqr/residues/GME.dat' 2024-05-10T12:02:22,275 adding 'moleculekit/share/pdb2pqr/residues/GME.xml' 2024-05-10T12:02:22,276 adding 'moleculekit/share/pdb2pqr/residues/GNC.dat' 2024-05-10T12:02:22,278 adding 'moleculekit/share/pdb2pqr/residues/GNC.xml' 2024-05-10T12:02:22,279 adding 'moleculekit/share/pdb2pqr/residues/HHK.dat' 2024-05-10T12:02:22,280 adding 'moleculekit/share/pdb2pqr/residues/HHK.xml' 2024-05-10T12:02:22,282 adding 'moleculekit/share/pdb2pqr/residues/HLU.dat' 2024-05-10T12:02:22,283 adding 'moleculekit/share/pdb2pqr/residues/HLU.xml' 2024-05-10T12:02:22,284 adding 'moleculekit/share/pdb2pqr/residues/HLX.dat' 2024-05-10T12:02:22,285 adding 'moleculekit/share/pdb2pqr/residues/HLX.xml' 2024-05-10T12:02:22,286 adding 'moleculekit/share/pdb2pqr/residues/HOX.dat' 2024-05-10T12:02:22,288 adding 'moleculekit/share/pdb2pqr/residues/HOX.xml' 2024-05-10T12:02:22,289 adding 'moleculekit/share/pdb2pqr/residues/HPE.dat' 2024-05-10T12:02:22,290 adding 'moleculekit/share/pdb2pqr/residues/HPE.xml' 2024-05-10T12:02:22,291 adding 'moleculekit/share/pdb2pqr/residues/HQA.dat' 2024-05-10T12:02:22,293 adding 'moleculekit/share/pdb2pqr/residues/HQA.xml' 2024-05-10T12:02:22,294 adding 'moleculekit/share/pdb2pqr/residues/HTR.dat' 2024-05-10T12:02:22,295 adding 'moleculekit/share/pdb2pqr/residues/HTR.xml' 2024-05-10T12:02:22,296 adding 'moleculekit/share/pdb2pqr/residues/HYP.dat' 2024-05-10T12:02:22,298 adding 'moleculekit/share/pdb2pqr/residues/HYP.xml' 2024-05-10T12:02:22,299 adding 'moleculekit/share/pdb2pqr/residues/I2M.dat' 2024-05-10T12:02:22,300 adding 'moleculekit/share/pdb2pqr/residues/I2M.xml' 2024-05-10T12:02:22,301 adding 'moleculekit/share/pdb2pqr/residues/IGL.dat' 2024-05-10T12:02:22,302 adding 'moleculekit/share/pdb2pqr/residues/IGL.xml' 2024-05-10T12:02:22,304 adding 'moleculekit/share/pdb2pqr/residues/IIL.dat' 2024-05-10T12:02:22,305 adding 'moleculekit/share/pdb2pqr/residues/IIL.xml' 2024-05-10T12:02:22,306 adding 'moleculekit/share/pdb2pqr/residues/IML.dat' 2024-05-10T12:02:22,307 adding 'moleculekit/share/pdb2pqr/residues/IML.xml' 2024-05-10T12:02:22,308 adding 'moleculekit/share/pdb2pqr/residues/KYN.dat' 2024-05-10T12:02:22,310 adding 'moleculekit/share/pdb2pqr/residues/KYN.xml' 2024-05-10T12:02:22,311 adding 'moleculekit/share/pdb2pqr/residues/LME.dat' 2024-05-10T12:02:22,312 adding 'moleculekit/share/pdb2pqr/residues/LME.xml' 2024-05-10T12:02:22,313 adding 'moleculekit/share/pdb2pqr/residues/LMQ.dat' 2024-05-10T12:02:22,314 adding 'moleculekit/share/pdb2pqr/residues/LMQ.xml' 2024-05-10T12:02:22,316 adding 'moleculekit/share/pdb2pqr/residues/LYZ.dat' 2024-05-10T12:02:22,317 adding 'moleculekit/share/pdb2pqr/residues/LYZ.xml' 2024-05-10T12:02:22,318 adding 'moleculekit/share/pdb2pqr/residues/M3L.dat' 2024-05-10T12:02:22,319 adding 'moleculekit/share/pdb2pqr/residues/M3L.xml' 2024-05-10T12:02:22,320 adding 'moleculekit/share/pdb2pqr/residues/ME0.dat' 2024-05-10T12:02:22,322 adding 'moleculekit/share/pdb2pqr/residues/ME0.xml' 2024-05-10T12:02:22,323 adding 'moleculekit/share/pdb2pqr/residues/MEA.dat' 2024-05-10T12:02:22,324 adding 'moleculekit/share/pdb2pqr/residues/MEA.xml' 2024-05-10T12:02:22,325 adding 'moleculekit/share/pdb2pqr/residues/MEN.dat' 2024-05-10T12:02:22,326 adding 'moleculekit/share/pdb2pqr/residues/MEN.xml' 2024-05-10T12:02:22,328 adding 'moleculekit/share/pdb2pqr/residues/MEQ.dat' 2024-05-10T12:02:22,329 adding 'moleculekit/share/pdb2pqr/residues/MEQ.xml' 2024-05-10T12:02:22,330 adding 'moleculekit/share/pdb2pqr/residues/MLE.dat' 2024-05-10T12:02:22,331 adding 'moleculekit/share/pdb2pqr/residues/MLE.xml' 2024-05-10T12:02:22,332 adding 'moleculekit/share/pdb2pqr/residues/MLY.dat' 2024-05-10T12:02:22,334 adding 'moleculekit/share/pdb2pqr/residues/MLY.xml' 2024-05-10T12:02:22,335 adding 'moleculekit/share/pdb2pqr/residues/MLZ.dat' 2024-05-10T12:02:22,336 adding 'moleculekit/share/pdb2pqr/residues/MLZ.xml' 2024-05-10T12:02:22,337 adding 'moleculekit/share/pdb2pqr/residues/MME.dat' 2024-05-10T12:02:22,338 adding 'moleculekit/share/pdb2pqr/residues/MME.xml' 2024-05-10T12:02:22,339 adding 'moleculekit/share/pdb2pqr/residues/MMO.dat' 2024-05-10T12:02:22,341 adding 'moleculekit/share/pdb2pqr/residues/MMO.xml' 2024-05-10T12:02:22,342 adding 'moleculekit/share/pdb2pqr/residues/MVA.dat' 2024-05-10T12:02:22,343 adding 'moleculekit/share/pdb2pqr/residues/MVA.xml' 2024-05-10T12:02:22,344 adding 'moleculekit/share/pdb2pqr/residues/NAL.dat' 2024-05-10T12:02:22,345 adding 'moleculekit/share/pdb2pqr/residues/NAL.xml' 2024-05-10T12:02:22,347 adding 'moleculekit/share/pdb2pqr/residues/NCY.dat' 2024-05-10T12:02:22,348 adding 'moleculekit/share/pdb2pqr/residues/NCY.xml' 2024-05-10T12:02:22,349 adding 'moleculekit/share/pdb2pqr/residues/NLE.dat' 2024-05-10T12:02:22,350 adding 'moleculekit/share/pdb2pqr/residues/NLE.xml' 2024-05-10T12:02:22,351 adding 'moleculekit/share/pdb2pqr/residues/NVA.dat' 2024-05-10T12:02:22,353 adding 'moleculekit/share/pdb2pqr/residues/NVA.xml' 2024-05-10T12:02:22,354 adding 'moleculekit/share/pdb2pqr/residues/NZC.dat' 2024-05-10T12:02:22,355 adding 'moleculekit/share/pdb2pqr/residues/NZC.xml' 2024-05-10T12:02:22,356 adding 'moleculekit/share/pdb2pqr/residues/OCY.dat' 2024-05-10T12:02:22,357 adding 'moleculekit/share/pdb2pqr/residues/OCY.xml' 2024-05-10T12:02:22,358 adding 'moleculekit/share/pdb2pqr/residues/OMX.dat' 2024-05-10T12:02:22,360 adding 'moleculekit/share/pdb2pqr/residues/OMX.xml' 2024-05-10T12:02:22,361 adding 'moleculekit/share/pdb2pqr/residues/ONL.dat' 2024-05-10T12:02:22,362 adding 'moleculekit/share/pdb2pqr/residues/ONL.xml' 2024-05-10T12:02:22,363 adding 'moleculekit/share/pdb2pqr/residues/ORM.dat' 2024-05-10T12:02:22,364 adding 'moleculekit/share/pdb2pqr/residues/ORM.xml' 2024-05-10T12:02:22,366 adding 'moleculekit/share/pdb2pqr/residues/P1L.dat' 2024-05-10T12:02:22,367 adding 'moleculekit/share/pdb2pqr/residues/P1L.xml' 2024-05-10T12:02:22,368 adding 'moleculekit/share/pdb2pqr/residues/PCA.dat' 2024-05-10T12:02:22,370 adding 'moleculekit/share/pdb2pqr/residues/PCA.xml' 2024-05-10T12:02:22,371 adding 'moleculekit/share/pdb2pqr/residues/PRK.dat' 2024-05-10T12:02:22,372 adding 'moleculekit/share/pdb2pqr/residues/PRK.xml' 2024-05-10T12:02:22,373 adding 'moleculekit/share/pdb2pqr/residues/PTR.dat' 2024-05-10T12:02:22,374 adding 'moleculekit/share/pdb2pqr/residues/PTR.xml' 2024-05-10T12:02:22,376 adding 'moleculekit/share/pdb2pqr/residues/SEP.dat' 2024-05-10T12:02:22,377 adding 'moleculekit/share/pdb2pqr/residues/SEP.xml' 2024-05-10T12:02:22,378 adding 'moleculekit/share/pdb2pqr/residues/TPO.dat' 2024-05-10T12:02:22,379 adding 'moleculekit/share/pdb2pqr/residues/TPO.xml' 2024-05-10T12:02:22,380 adding 'moleculekit/share/pdb2pqr/residues/TRO.dat' 2024-05-10T12:02:22,382 adding 'moleculekit/share/pdb2pqr/residues/TRO.xml' 2024-05-10T12:02:22,383 adding 'moleculekit/share/pdb2pqr/residues/TY2.dat' 2024-05-10T12:02:22,384 adding 'moleculekit/share/pdb2pqr/residues/TY2.xml' 2024-05-10T12:02:22,385 adding 'moleculekit/share/pdb2pqr/residues/TYQ.dat' 2024-05-10T12:02:22,386 adding 'moleculekit/share/pdb2pqr/residues/TYQ.xml' 2024-05-10T12:02:22,388 adding 'moleculekit/share/pdb2pqr/residues/YCM.dat' 2024-05-10T12:02:22,389 adding 'moleculekit/share/pdb2pqr/residues/YCM.xml' 2024-05-10T12:02:22,390 adding 'moleculekit/share/pdb2pqr/residues/YNM.dat' 2024-05-10T12:02:22,391 adding 'moleculekit/share/pdb2pqr/residues/YNM.xml' 2024-05-10T12:02:22,393 adding 'moleculekit/smallmol/__init__.py' 2024-05-10T12:02:22,398 adding 'moleculekit/smallmol/smallmol.py' 2024-05-10T12:02:22,400 adding 'moleculekit/smallmol/smallmolcdp.py' 2024-05-10T12:02:22,403 adding 'moleculekit/smallmol/smallmollib.py' 2024-05-10T12:02:22,404 adding 'moleculekit/smallmol/test_smallmol.py' 2024-05-10T12:02:22,406 adding 'moleculekit/smallmol/test_smallmollib.py' 2024-05-10T12:02:22,408 adding 'moleculekit/smallmol/util.py' 2024-05-10T12:02:22,410 adding 'moleculekit/smallmol/tools/__init__.py' 2024-05-10T12:02:22,411 adding 'moleculekit/smallmol/tools/clustering.py' 2024-05-10T12:02:22,413 adding 'moleculekit/smallmol/tools/restrainedembed.py' 2024-05-10T12:02:22,414 adding 'moleculekit/smallmol/tools/test_tools.py' 2024-05-10T12:02:22,504 adding 'moleculekit/tmalign/tmalign_util.cpp' 2024-05-10T12:02:22,513 adding 'moleculekit/tmalign/tmalign_util.pyx' 2024-05-10T12:02:22,514 adding 'moleculekit/tmalign/tmalignlib.pxd' 2024-05-10T12:02:22,516 adding 'moleculekit/tmalign/include/TMAlign.h' 2024-05-10T12:02:22,533 adding 'moleculekit/tmalign/src/TMAlign.cpp' 2024-05-10T12:02:22,537 adding 'moleculekit/tools/__init__.py' 2024-05-10T12:02:22,539 adding 'moleculekit/tools/atomtyper.py' 2024-05-10T12:02:22,541 adding 'moleculekit/tools/autosegment.py' 2024-05-10T12:02:22,543 adding 'moleculekit/tools/crystalpacking.py' 2024-05-10T12:02:22,547 adding 'moleculekit/tools/detect.py' 2024-05-10T12:02:22,549 adding 'moleculekit/tools/docking.py' 2024-05-10T12:02:22,551 adding 'moleculekit/tools/graphalignment.py' 2024-05-10T12:02:22,552 adding 'moleculekit/tools/hhblitsprofile.py' 2024-05-10T12:02:22,554 adding 'moleculekit/tools/modelling.py' 2024-05-10T12:02:22,555 adding 'moleculekit/tools/moleculechecks.py' 2024-05-10T12:02:22,562 adding 'moleculekit/tools/preparation.py' 2024-05-10T12:02:22,564 adding 'moleculekit/tools/preparation_customres.py' 2024-05-10T12:02:22,566 adding 'moleculekit/tools/sequencestructuralalignment.py' 2024-05-10T12:02:22,569 adding 'moleculekit/tools/voxeldescriptors.py' 2024-05-10T12:02:22,571 adding 'moleculekit/tools/obabel_tools/__init__.py' 2024-05-10T12:02:22,573 adding 'moleculekit/tools/obabel_tools/obabel_cli.py' 2024-05-10T12:02:22,665 adding 'moleculekit/wrapping/wrapping.cpp' 2024-05-10T12:02:22,674 adding 'moleculekit/wrapping/wrapping.pyx' 2024-05-10T12:02:22,676 adding 'moleculekit-1.8.32.dist-info/LICENSE' 2024-05-10T12:02:22,677 adding 'moleculekit-1.8.32.dist-info/METADATA' 2024-05-10T12:02:22,679 adding 'moleculekit-1.8.32.dist-info/WHEEL' 2024-05-10T12:02:22,679 adding 'moleculekit-1.8.32.dist-info/top_level.txt' 2024-05-10T12:02:22,685 adding 'moleculekit-1.8.32.dist-info/RECORD' 2024-05-10T12:02:22,850 removing build/bdist.linux-armv7l/wheel 2024-05-10T12:02:23,132 Building wheel for moleculekit (pyproject.toml): finished with status 'done' 2024-05-10T12:02:23,446 Created wheel for moleculekit: filename=moleculekit-1.8.32-cp39-cp39-linux_armv7l.whl size=14905337 sha256=088f285bb9579634e6a88a6ce995af058e2091f60ca38a9a71b19acea17e339b 2024-05-10T12:02:23,447 Stored in directory: /tmp/pip-ephem-wheel-cache-zmmv29i7/wheels/1a/ff/af/d3dfd847be9bfbf9b5510ee683473fb8a5d84da4a6fff6d10f 2024-05-10T12:02:23,475 Successfully built moleculekit 2024-05-10T12:02:23,819 Removed build tracker: '/tmp/pip-build-tracker-mlpo9wa5'