2024-07-11T14:14:49,041 Created temporary directory: /tmp/pip-build-tracker-atqtv3tc 2024-07-11T14:14:49,042 Initialized build tracking at /tmp/pip-build-tracker-atqtv3tc 2024-07-11T14:14:49,043 Created build tracker: /tmp/pip-build-tracker-atqtv3tc 2024-07-11T14:14:49,043 Entered build tracker: /tmp/pip-build-tracker-atqtv3tc 2024-07-11T14:14:49,043 Created temporary directory: /tmp/pip-wheel-nseajkrs 2024-07-11T14:14:49,047 Created temporary directory: /tmp/pip-ephem-wheel-cache-ooyp6qe9 2024-07-11T14:14:49,071 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-07-11T14:14:49,075 2 location(s) to search for versions of moleculekit: 2024-07-11T14:14:49,075 * https://pypi.org/simple/moleculekit/ 2024-07-11T14:14:49,075 * https://www.piwheels.org/simple/moleculekit/ 2024-07-11T14:14:49,075 Fetching project page and analyzing links: https://pypi.org/simple/moleculekit/ 2024-07-11T14:14:49,076 Getting page https://pypi.org/simple/moleculekit/ 2024-07-11T14:14:49,077 Found index url https://pypi.org/simple/ 2024-07-11T14:14:49,210 Fetched page https://pypi.org/simple/moleculekit/ as application/vnd.pypi.simple.v1+json 2024-07-11T14:14:49,264 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/) 2024-07-11T14:14:49,265 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 2024-07-11T14:14:49,265 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/) 2024-07-11T14:14:49,265 Found link 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version: 1.9.0 2024-07-11T14:14:49,369 Found link https://files.pythonhosted.org/packages/03/ac/c81679ee7481d8dd7e0fa576dafe3963c48c065ab2ca808b53f59693c211/moleculekit-1.9.1.tar.gz (from https://pypi.org/simple/moleculekit/) (requires-python:>=3.8), version: 1.9.1 2024-07-11T14:14:49,370 Found link https://files.pythonhosted.org/packages/32/f1/d21bc1d0589eb9e230a6f35f2650e452a0f85915c109cf8284747fea3232/moleculekit-1.9.2.tar.gz (from https://pypi.org/simple/moleculekit/) (requires-python:>=3.8), version: 1.9.2 2024-07-11T14:14:49,370 Fetching project page and analyzing links: https://www.piwheels.org/simple/moleculekit/ 2024-07-11T14:14:49,371 Getting page https://www.piwheels.org/simple/moleculekit/ 2024-07-11T14:14:49,372 Found index url https://www.piwheels.org/simple/ 2024-07-11T14:14:49,460 Fetched page https://www.piwheels.org/simple/moleculekit/ as text/html 2024-07-11T14:14:49,563 Skipping link: No binaries permitted for moleculekit: 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https://www.piwheels.org/simple/moleculekit/moleculekit-0.1.5-py3-none-any.whl#sha256=2f111e31b3f90e63ca0154c528585208b8bd41a065aa0078325683f4b36eacec (from https://www.piwheels.org/simple/moleculekit/) 2024-07-11T14:14:49,633 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/) 2024-07-11T14:14:49,633 Skipping link: not a file: https://www.piwheels.org/simple/moleculekit/ 2024-07-11T14:14:49,633 Skipping link: not a file: https://pypi.org/simple/moleculekit/ 2024-07-11T14:14:49,703 Given no hashes to check 1 links for project 'moleculekit': discarding no candidates 2024-07-11T14:14:49,721 Collecting moleculekit==1.9.1 2024-07-11T14:14:49,723 Created temporary directory: /tmp/pip-unpack-nvzbsq45 2024-07-11T14:14:49,766 Downloading moleculekit-1.9.1.tar.gz (6.8 MB) 2024-07-11T14:14:52,179 Added moleculekit==1.9.1 from https://files.pythonhosted.org/packages/03/ac/c81679ee7481d8dd7e0fa576dafe3963c48c065ab2ca808b53f59693c211/moleculekit-1.9.1.tar.gz to build tracker '/tmp/pip-build-tracker-atqtv3tc' 2024-07-11T14:14:52,187 Created temporary directory: /tmp/pip-build-env-k7hm872d 2024-07-11T14:14:52,197 Installing build dependencies: started 2024-07-11T14:14:52,198 Running command pip subprocess to install build dependencies 2024-07-11T14:14:53,414 Using pip 24.0 from /usr/local/lib/python3.9/dist-packages/pip (python 3.9) 2024-07-11T14:14:53,954 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2024-07-11T14:14:55,442 Collecting setuptools 2024-07-11T14:14:55,459 Using cached https://www.piwheels.org/simple/setuptools/setuptools-70.3.0-py3-none-any.whl (931 kB) 2024-07-11T14:14:56,549 Collecting numpy>=1.18.5 2024-07-11T14:14:56,567 Using cached https://www.piwheels.org/simple/numpy/numpy-2.0.0-cp39-cp39-linux_armv7l.whl (5.8 MB) 2024-07-11T14:14:58,177 Collecting Cython>=0.29.21 2024-07-11T14:14:58,196 Using cached https://www.piwheels.org/simple/cython/Cython-3.0.10-cp39-cp39-linux_armv7l.whl (10.7 MB) 2024-07-11T14:14:58,596 Collecting toml 2024-07-11T14:14:58,614 Using cached https://www.piwheels.org/simple/toml/toml-0.10.2-py2.py3-none-any.whl (16 kB) 2024-07-11T14:14:58,715 Collecting versioneer==0.28 (from versioneer[toml]==0.28) 2024-07-11T14:14:58,734 Using cached https://www.piwheels.org/simple/versioneer/versioneer-0.28-py3-none-any.whl (45 kB) 2024-07-11T14:14:58,896 Collecting tomli (from versioneer[toml]==0.28) 2024-07-11T14:14:58,914 Using cached https://www.piwheels.org/simple/tomli/tomli-2.0.1-py3-none-any.whl (12 kB) 2024-07-11T14:15:00,756 Installing collected packages: versioneer, tomli, toml, setuptools, numpy, Cython 2024-07-11T14:15:00,794 Creating /tmp/pip-build-env-k7hm872d/overlay/bin 2024-07-11T14:15:00,797 changing mode of /tmp/pip-build-env-k7hm872d/overlay/bin/versioneer to 755 2024-07-11T14:15:11,663 changing mode of /tmp/pip-build-env-k7hm872d/overlay/bin/f2py to 755 2024-07-11T14:15:11,666 changing mode of /tmp/pip-build-env-k7hm872d/overlay/bin/numpy-config to 755 2024-07-11T14:15:15,189 changing mode of /tmp/pip-build-env-k7hm872d/overlay/bin/cygdb to 755 2024-07-11T14:15:15,193 changing mode of /tmp/pip-build-env-k7hm872d/overlay/bin/cython to 755 2024-07-11T14:15:15,197 changing mode of /tmp/pip-build-env-k7hm872d/overlay/bin/cythonize to 755 2024-07-11T14:15:15,274 Successfully installed Cython-3.0.10 numpy-2.0.0 setuptools-70.3.0 toml-0.10.2 tomli-2.0.1 versioneer-0.28 2024-07-11T14:15:15,496 [notice] A new release of pip is available: 24.0 -> 24.1.2 2024-07-11T14:15:15,497 [notice] To update, run: python3 -m pip install --upgrade pip 2024-07-11T14:15:15,997 Installing build dependencies: finished with status 'done' 2024-07-11T14:15:16,003 Getting requirements to build wheel: started 2024-07-11T14:15:16,004 Running command Getting requirements to build wheel 2024-07-11T14:15:55,894 warning: moleculekit/wrapping/wrapping.pyx:47:4: Unreachable code 2024-07-11T14:16:05,717 Compiling moleculekit/interactions/hbonds/hbonds.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,718 Compiling moleculekit/interactions/pipi/pipi.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,718 Compiling moleculekit/interactions/cationpi/cationpi.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,718 Compiling moleculekit/interactions/sigmahole/sigmahole.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,718 Compiling moleculekit/wrapping/wrapping.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,718 Compiling moleculekit/bondguesser_utils/bondguesser_utils.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,718 Compiling moleculekit/atomselect_utils/atomselect_utils.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,718 Compiling moleculekit/distance_utils/distance_utils.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,719 Compiling moleculekit/occupancy_utils/occupancy_utils.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,719 Compiling moleculekit/cython_utils/cython_utils.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,719 Compiling moleculekit/fileformats/xtc/xtc.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-07-11T14:16:05,719 Compiling moleculekit/fileformats/xtc/trr.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-07-11T14:16:05,719 Compiling moleculekit/fileformats/dcd/dcd.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-07-11T14:16:05,719 Compiling moleculekit/fileformats/binpos/binpos.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libc/string.pxd. 2024-07-11T14:16:05,719 Compiling moleculekit/tmalign/tmalign_util.pyx because it depends on /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/Cython/Includes/libcpp/vector.pxd. 2024-07-11T14:16:05,720 [ 1/15] Cythonizing moleculekit/atomselect_utils/atomselect_utils.pyx 2024-07-11T14:16:05,720 [ 2/15] Cythonizing moleculekit/bondguesser_utils/bondguesser_utils.pyx 2024-07-11T14:16:05,720 [ 3/15] Cythonizing moleculekit/cython_utils/cython_utils.pyx 2024-07-11T14:16:05,720 [ 4/15] Cythonizing moleculekit/distance_utils/distance_utils.pyx 2024-07-11T14:16:05,720 [ 5/15] Cythonizing moleculekit/fileformats/dcd/dcd.pyx 2024-07-11T14:16:05,720 [ 6/15] Cythonizing moleculekit/interactions/cationpi/cationpi.pyx 2024-07-11T14:16:05,720 [ 7/15] Cythonizing moleculekit/interactions/hbonds/hbonds.pyx 2024-07-11T14:16:05,720 [ 8/15] Cythonizing moleculekit/interactions/pipi/pipi.pyx 2024-07-11T14:16:05,721 [ 9/15] Cythonizing moleculekit/interactions/sigmahole/sigmahole.pyx 2024-07-11T14:16:05,721 [10/15] Cythonizing moleculekit/occupancy_utils/occupancy_utils.pyx 2024-07-11T14:16:05,721 [11/15] Cythonizing moleculekit/tmalign/tmalign_util.pyx 2024-07-11T14:16:05,721 [12/15] Cythonizing moleculekit/wrapping/wrapping.pyx 2024-07-11T14:16:05,721 [13/15] Cythonizing moleculekit/fileformats/binpos/binpos.pyx 2024-07-11T14:16:05,721 [14/15] Cythonizing moleculekit/fileformats/xtc/trr.pyx 2024-07-11T14:16:05,721 [15/15] Cythonizing moleculekit/fileformats/xtc/xtc.pyx 2024-07-11T14:16:06,147 running egg_info 2024-07-11T14:16:06,154 writing moleculekit.egg-info/PKG-INFO 2024-07-11T14:16:06,159 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-07-11T14:16:06,162 writing requirements to moleculekit.egg-info/requires.txt 2024-07-11T14:16:06,164 writing top-level names to moleculekit.egg-info/top_level.txt 2024-07-11T14:16:06,209 dependency /tmp/pip-build-env-k7hm872d/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 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build wheel: finished with status 'done' 2024-07-11T14:16:08,505 Created temporary directory: /tmp/pip-modern-metadata-qm7_5x8v 2024-07-11T14:16:08,507 Preparing metadata (pyproject.toml): started 2024-07-11T14:16:08,508 Running command Preparing metadata (pyproject.toml) 2024-07-11T14:16:10,930 running dist_info 2024-07-11T14:16:10,932 creating /tmp/pip-modern-metadata-qm7_5x8v/moleculekit.egg-info 2024-07-11T14:16:10,938 writing /tmp/pip-modern-metadata-qm7_5x8v/moleculekit.egg-info/PKG-INFO 2024-07-11T14:16:10,943 writing dependency_links to /tmp/pip-modern-metadata-qm7_5x8v/moleculekit.egg-info/dependency_links.txt 2024-07-11T14:16:10,945 writing requirements to /tmp/pip-modern-metadata-qm7_5x8v/moleculekit.egg-info/requires.txt 2024-07-11T14:16:10,946 writing top-level names to /tmp/pip-modern-metadata-qm7_5x8v/moleculekit.egg-info/top_level.txt 2024-07-11T14:16:10,947 writing manifest file '/tmp/pip-modern-metadata-qm7_5x8v/moleculekit.egg-info/SOURCES.txt' 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the manifest: the path must be relative 2024-07-11T14:16:10,981 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,983 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,983 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,983 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,983 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,983 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,984 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,984 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,984 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,984 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,985 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,985 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,985 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,986 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,986 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,986 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:10,992 reading manifest file '/tmp/pip-modern-metadata-qm7_5x8v/moleculekit.egg-info/SOURCES.txt' 2024-07-11T14:16:10,994 reading manifest template 'MANIFEST.in' 2024-07-11T14:16:11,274 no previously-included directories found matching 'moleculekit/test-data' 2024-07-11T14:16:11,275 no previously-included directories found matching 'moleculekit/tests' 2024-07-11T14:16:11,276 no previously-included directories found matching 'package' 2024-07-11T14:16:11,276 adding license file 'LICENSE' 2024-07-11T14:16:11,290 writing manifest file '/tmp/pip-modern-metadata-qm7_5x8v/moleculekit.egg-info/SOURCES.txt' 2024-07-11T14:16:11,299 creating '/tmp/pip-modern-metadata-qm7_5x8v/moleculekit-1.9.1.dist-info' 2024-07-11T14:16:11,493 Preparing metadata (pyproject.toml): finished with status 'done' 2024-07-11T14:16:11,500 Source in /tmp/pip-wheel-nseajkrs/moleculekit_c6174a57457a428ba48762d4eba1a031 has version 1.9.1, which satisfies requirement moleculekit==1.9.1 from https://files.pythonhosted.org/packages/03/ac/c81679ee7481d8dd7e0fa576dafe3963c48c065ab2ca808b53f59693c211/moleculekit-1.9.1.tar.gz 2024-07-11T14:16:11,501 Removed moleculekit==1.9.1 from https://files.pythonhosted.org/packages/03/ac/c81679ee7481d8dd7e0fa576dafe3963c48c065ab2ca808b53f59693c211/moleculekit-1.9.1.tar.gz from build tracker '/tmp/pip-build-tracker-atqtv3tc' 2024-07-11T14:16:11,508 Created temporary directory: /tmp/pip-unpack-ften0cpx 2024-07-11T14:16:11,509 Created temporary directory: /tmp/pip-unpack-0eii25du 2024-07-11T14:16:11,516 Building wheels for collected packages: moleculekit 2024-07-11T14:16:11,522 Created temporary directory: /tmp/pip-wheel-wxh707jd 2024-07-11T14:16:11,522 Destination directory: /tmp/pip-wheel-wxh707jd 2024-07-11T14:16:11,525 Building wheel for moleculekit (pyproject.toml): started 2024-07-11T14:16:11,526 Running command Building wheel for moleculekit (pyproject.toml) 2024-07-11T14:16:13,847 running bdist_wheel 2024-07-11T14:16:13,864 running build 2024-07-11T14:16:13,865 running build_py 2024-07-11T14:16:13,873 creating build 2024-07-11T14:16:13,873 creating build/lib.linux-armv7l-cpython-39 2024-07-11T14:16:13,874 creating build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,876 copying moleculekit/vmdgraphics.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,879 copying moleculekit/bondguesser.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,881 copying moleculekit/rdkitintegration.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,883 copying moleculekit/distance.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,886 copying moleculekit/home.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,888 copying moleculekit/periodictable.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,891 copying moleculekit/dihedral.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,893 copying moleculekit/opm.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,896 copying moleculekit/_version.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,898 copying moleculekit/writers.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,902 copying moleculekit/rcsb.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,904 copying moleculekit/readers.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,910 copying moleculekit/align.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,912 copying moleculekit/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,915 copying moleculekit/molecule.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,919 copying moleculekit/pymolgraphics.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,921 copying moleculekit/version.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,923 copying moleculekit/viewer.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,926 copying moleculekit/vmdviewer.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,928 copying moleculekit/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,931 copying moleculekit/config.py -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:13,934 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-07-11T14:16:13,936 copying moleculekit/fileformats/netcdf.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-07-11T14:16:13,939 copying moleculekit/fileformats/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-07-11T14:16:13,941 copying moleculekit/fileformats/utils.py -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats 2024-07-11T14:16:13,945 creating build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,945 copying moleculekit/projections/metricshell.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,948 copying moleculekit/projections/projection.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,950 copying moleculekit/projections/metricsecondarystructure.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,952 copying moleculekit/projections/metricsphericalcoordinate.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,955 copying moleculekit/projections/metricfluctuation.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,958 copying moleculekit/projections/metricrmsd.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,961 copying moleculekit/projections/metricsasa.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,964 copying moleculekit/projections/metricdistance.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,967 copying moleculekit/projections/metricgyration.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,969 copying moleculekit/projections/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,971 copying moleculekit/projections/metriccoordinate.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,975 copying moleculekit/projections/metricdihedral.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,978 copying moleculekit/projections/metricplumed2.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,981 copying moleculekit/projections/metrictmscore.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,984 copying moleculekit/projections/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit/projections 2024-07-11T14:16:13,988 creating build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-07-11T14:16:13,989 copying moleculekit/smallmol/test_smallmol.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-07-11T14:16:13,992 copying moleculekit/smallmol/smallmolcdp.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-07-11T14:16:13,994 copying moleculekit/smallmol/smallmollib.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-07-11T14:16:13,997 copying moleculekit/smallmol/smallmol.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-07-11T14:16:14,001 copying moleculekit/smallmol/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-07-11T14:16:14,003 copying moleculekit/smallmol/test_smallmollib.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-07-11T14:16:14,005 copying moleculekit/smallmol/util.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol 2024-07-11T14:16:14,008 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx 2024-07-11T14:16:14,009 copying moleculekit/pdbx/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx 2024-07-11T14:16:14,012 creating build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-07-11T14:16:14,013 copying moleculekit/ply/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-07-11T14:16:14,014 copying moleculekit/ply/yacc.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-07-11T14:16:14,019 copying moleculekit/ply/lex.py -> build/lib.linux-armv7l-cpython-39/moleculekit/ply 2024-07-11T14:16:14,022 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-07-11T14:16:14,023 copying moleculekit/interactions/interactions.py -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-07-11T14:16:14,027 copying moleculekit/interactions/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions 2024-07-11T14:16:14,029 creating build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-07-11T14:16:14,030 copying moleculekit/atomselect/atomselect.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-07-11T14:16:14,032 copying moleculekit/atomselect/analyze.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-07-11T14:16:14,034 copying moleculekit/atomselect/languageparser.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-07-11T14:16:14,037 copying moleculekit/atomselect/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect 2024-07-11T14:16:14,039 creating build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,040 copying moleculekit/tools/autosegment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,043 copying moleculekit/tools/atomtyper.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,045 copying moleculekit/tools/docking.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,048 copying moleculekit/tools/moleculechecks.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,050 copying moleculekit/tools/graphalignment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,053 copying moleculekit/tools/preparation_customres.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,055 copying moleculekit/tools/voxeldescriptors.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,058 copying moleculekit/tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,060 copying moleculekit/tools/modelling.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,062 copying moleculekit/tools/preparation.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,065 copying moleculekit/tools/crystalpacking.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,068 copying moleculekit/tools/sequencestructuralalignment.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,070 copying moleculekit/tools/detect.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,073 copying moleculekit/tools/hhblitsprofile.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools 2024-07-11T14:16:14,075 creating build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-07-11T14:16:14,077 copying moleculekit/smallmol/tools/restrainedembed.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-07-11T14:16:14,078 copying moleculekit/smallmol/tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-07-11T14:16:14,080 copying moleculekit/smallmol/tools/clustering.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-07-11T14:16:14,083 copying moleculekit/smallmol/tools/test_tools.py -> build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools 2024-07-11T14:16:14,086 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-07-11T14:16:14,087 copying moleculekit/pdbx/reader/PdbxReader.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-07-11T14:16:14,090 copying moleculekit/pdbx/reader/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-07-11T14:16:14,091 copying moleculekit/pdbx/reader/PdbxContainers.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-07-11T14:16:14,094 copying moleculekit/pdbx/reader/BinaryCifReader.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-07-11T14:16:14,097 copying moleculekit/pdbx/reader/PdbxParser.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader 2024-07-11T14:16:14,100 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-07-11T14:16:14,101 copying moleculekit/pdbx/writer/PdbxWriter.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-07-11T14:16:14,104 copying moleculekit/pdbx/writer/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer 2024-07-11T14:16:14,106 creating build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-07-11T14:16:14,107 copying moleculekit/pdbx/tests/PdbxReaderTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-07-11T14:16:14,109 copying moleculekit/pdbx/tests/PdbxWriterTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-07-11T14:16:14,111 copying moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-07-11T14:16:14,114 copying moleculekit/pdbx/tests/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests 2024-07-11T14:16:14,116 creating build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-07-11T14:16:14,117 copying moleculekit/tools/obabel_tools/__init__.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-07-11T14:16:14,119 copying moleculekit/tools/obabel_tools/obabel_cli.py -> build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools 2024-07-11T14:16:14,121 running egg_info 2024-07-11T14:16:14,127 writing moleculekit.egg-info/PKG-INFO 2024-07-11T14:16:14,130 writing dependency_links to moleculekit.egg-info/dependency_links.txt 2024-07-11T14:16:14,132 writing requirements to moleculekit.egg-info/requires.txt 2024-07-11T14:16:14,133 writing top-level names to moleculekit.egg-info/top_level.txt 2024-07-11T14:16:14,154 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,154 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,154 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,155 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,155 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,155 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,155 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,155 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,155 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,155 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,156 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,156 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,156 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,156 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,156 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,156 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,156 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,157 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,157 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,157 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,157 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,157 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,157 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,157 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,157 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,158 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,158 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,158 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,158 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,158 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,158 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,158 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,158 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,159 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,159 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,159 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,159 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,159 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,159 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,159 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,159 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,160 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,160 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,160 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,160 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,160 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,160 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,160 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,160 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,160 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,161 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,161 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,161 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,161 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,161 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,161 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,162 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,162 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,162 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,162 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,163 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,164 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,164 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,164 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,164 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,165 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,165 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,165 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,165 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,165 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,166 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,166 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,167 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,167 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,167 dependency /tmp/pip-build-env-k7hm872d/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 2024-07-11T14:16:14,173 reading manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-07-11T14:16:14,182 reading manifest template 'MANIFEST.in' 2024-07-11T14:16:14,474 no previously-included directories found matching 'moleculekit/test-data' 2024-07-11T14:16:14,476 no previously-included directories found matching 'moleculekit/tests' 2024-07-11T14:16:14,477 no previously-included directories found matching 'package' 2024-07-11T14:16:14,477 adding license file 'LICENSE' 2024-07-11T14:16:14,496 writing manifest file 'moleculekit.egg-info/SOURCES.txt' 2024-07-11T14:16:14,507 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.atomselect_utils' is absent from the `packages` configuration. 2024-07-11T14:16:14,507 !! 2024-07-11T14:16:14,508 ******************************************************************************** 2024-07-11T14:16:14,508 ############################ 2024-07-11T14:16:14,508 # Package would be ignored # 2024-07-11T14:16:14,508 ############################ 2024-07-11T14:16:14,508 Python recognizes 'moleculekit.atomselect_utils' as an importable package[^1], 2024-07-11T14:16:14,508 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,508 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,509 package, please make sure that 'moleculekit.atomselect_utils' is explicitly added 2024-07-11T14:16:14,509 to the `packages` configuration field. 2024-07-11T14:16:14,509 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,509 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,509 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,509 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,510 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,510 If you don't want 'moleculekit.atomselect_utils' to be distributed and are 2024-07-11T14:16:14,510 already explicitly excluding 'moleculekit.atomselect_utils' via 2024-07-11T14:16:14,510 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,510 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,510 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,510 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,511 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,511 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,511 even if it does not contain any `.py` files. 2024-07-11T14:16:14,511 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,511 directory, all directories are treated like packages. 2024-07-11T14:16:14,511 ******************************************************************************** 2024-07-11T14:16:14,512 !! 2024-07-11T14:16:14,512 check.warn(importable) 2024-07-11T14:16:14,512 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.bondguesser_utils' is absent from the `packages` configuration. 2024-07-11T14:16:14,512 !! 2024-07-11T14:16:14,512 ******************************************************************************** 2024-07-11T14:16:14,512 ############################ 2024-07-11T14:16:14,513 # Package would be ignored # 2024-07-11T14:16:14,513 ############################ 2024-07-11T14:16:14,513 Python recognizes 'moleculekit.bondguesser_utils' as an importable package[^1], 2024-07-11T14:16:14,513 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,513 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,513 package, please make sure that 'moleculekit.bondguesser_utils' is explicitly added 2024-07-11T14:16:14,513 to the `packages` configuration field. 2024-07-11T14:16:14,514 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,514 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,514 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,514 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,514 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,514 If you don't want 'moleculekit.bondguesser_utils' to be distributed and are 2024-07-11T14:16:14,515 already explicitly excluding 'moleculekit.bondguesser_utils' via 2024-07-11T14:16:14,515 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,515 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,515 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,515 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,515 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,516 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,516 even if it does not contain any `.py` files. 2024-07-11T14:16:14,516 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,516 directory, all directories are treated like packages. 2024-07-11T14:16:14,516 ******************************************************************************** 2024-07-11T14:16:14,516 !! 2024-07-11T14:16:14,517 check.warn(importable) 2024-07-11T14:16:14,517 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.cython_utils' is absent from the `packages` configuration. 2024-07-11T14:16:14,517 !! 2024-07-11T14:16:14,517 ******************************************************************************** 2024-07-11T14:16:14,517 ############################ 2024-07-11T14:16:14,517 # Package would be ignored # 2024-07-11T14:16:14,517 ############################ 2024-07-11T14:16:14,517 Python recognizes 'moleculekit.cython_utils' as an importable package[^1], 2024-07-11T14:16:14,518 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,518 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,518 package, please make sure that 'moleculekit.cython_utils' is explicitly added 2024-07-11T14:16:14,518 to the `packages` configuration field. 2024-07-11T14:16:14,518 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,518 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,518 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,519 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,519 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,519 If you don't want 'moleculekit.cython_utils' to be distributed and are 2024-07-11T14:16:14,519 already explicitly excluding 'moleculekit.cython_utils' via 2024-07-11T14:16:14,519 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,519 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,520 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,520 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,520 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,520 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,520 even if it does not contain any `.py` files. 2024-07-11T14:16:14,520 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,521 directory, all directories are treated like packages. 2024-07-11T14:16:14,521 ******************************************************************************** 2024-07-11T14:16:14,521 !! 2024-07-11T14:16:14,521 check.warn(importable) 2024-07-11T14:16:14,521 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.distance_utils' is absent from the `packages` configuration. 2024-07-11T14:16:14,521 !! 2024-07-11T14:16:14,521 ******************************************************************************** 2024-07-11T14:16:14,521 ############################ 2024-07-11T14:16:14,522 # Package would be ignored # 2024-07-11T14:16:14,522 ############################ 2024-07-11T14:16:14,522 Python recognizes 'moleculekit.distance_utils' as an importable package[^1], 2024-07-11T14:16:14,522 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,522 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,522 package, please make sure that 'moleculekit.distance_utils' is explicitly added 2024-07-11T14:16:14,522 to the `packages` configuration field. 2024-07-11T14:16:14,523 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,523 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,523 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,523 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,523 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,523 If you don't want 'moleculekit.distance_utils' to be distributed and are 2024-07-11T14:16:14,523 already explicitly excluding 'moleculekit.distance_utils' via 2024-07-11T14:16:14,524 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,524 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,524 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,524 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,524 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,524 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,525 even if it does not contain any `.py` files. 2024-07-11T14:16:14,525 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,525 directory, all directories are treated like packages. 2024-07-11T14:16:14,525 ******************************************************************************** 2024-07-11T14:16:14,525 !! 2024-07-11T14:16:14,525 check.warn(importable) 2024-07-11T14:16:14,525 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.fileformats.binpos' is absent from the `packages` configuration. 2024-07-11T14:16:14,525 !! 2024-07-11T14:16:14,526 ******************************************************************************** 2024-07-11T14:16:14,526 ############################ 2024-07-11T14:16:14,526 # Package would be ignored # 2024-07-11T14:16:14,526 ############################ 2024-07-11T14:16:14,526 Python recognizes 'moleculekit.fileformats.binpos' as an importable package[^1], 2024-07-11T14:16:14,526 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,526 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,527 package, please make sure that 'moleculekit.fileformats.binpos' is explicitly added 2024-07-11T14:16:14,527 to the `packages` configuration field. 2024-07-11T14:16:14,527 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,527 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,527 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,527 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,527 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,528 If you don't want 'moleculekit.fileformats.binpos' to be distributed and are 2024-07-11T14:16:14,528 already explicitly excluding 'moleculekit.fileformats.binpos' via 2024-07-11T14:16:14,528 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,528 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,528 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,528 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,528 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,529 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,529 even if it does not contain any `.py` files. 2024-07-11T14:16:14,529 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,529 directory, all directories are treated like packages. 2024-07-11T14:16:14,529 ******************************************************************************** 2024-07-11T14:16:14,530 !! 2024-07-11T14:16:14,530 check.warn(importable) 2024-07-11T14:16:14,530 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.fileformats.binpos.include' is absent from the `packages` configuration. 2024-07-11T14:16:14,530 !! 2024-07-11T14:16:14,530 ******************************************************************************** 2024-07-11T14:16:14,530 ############################ 2024-07-11T14:16:14,530 # Package would be ignored # 2024-07-11T14:16:14,530 ############################ 2024-07-11T14:16:14,531 Python recognizes 'moleculekit.fileformats.binpos.include' as an importable package[^1], 2024-07-11T14:16:14,531 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,531 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,531 package, please make sure that 'moleculekit.fileformats.binpos.include' is explicitly added 2024-07-11T14:16:14,531 to the `packages` configuration field. 2024-07-11T14:16:14,531 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,531 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,532 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,532 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,532 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,532 If you don't want 'moleculekit.fileformats.binpos.include' to be distributed and are 2024-07-11T14:16:14,532 already explicitly excluding 'moleculekit.fileformats.binpos.include' via 2024-07-11T14:16:14,532 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,532 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,533 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,533 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,533 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,533 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,533 even if it does not contain any `.py` files. 2024-07-11T14:16:14,534 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,534 directory, all directories are treated like packages. 2024-07-11T14:16:14,534 ******************************************************************************** 2024-07-11T14:16:14,534 !! 2024-07-11T14:16:14,534 check.warn(importable) 2024-07-11T14:16:14,534 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.fileformats.binpos.src' is absent from the `packages` configuration. 2024-07-11T14:16:14,534 !! 2024-07-11T14:16:14,535 ******************************************************************************** 2024-07-11T14:16:14,535 ############################ 2024-07-11T14:16:14,535 # Package would be ignored # 2024-07-11T14:16:14,535 ############################ 2024-07-11T14:16:14,535 Python recognizes 'moleculekit.fileformats.binpos.src' as an importable package[^1], 2024-07-11T14:16:14,535 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,535 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,535 package, please make sure that 'moleculekit.fileformats.binpos.src' is explicitly added 2024-07-11T14:16:14,535 to the `packages` configuration field. 2024-07-11T14:16:14,536 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,536 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,536 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,536 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,536 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,537 If you don't want 'moleculekit.fileformats.binpos.src' to be distributed and are 2024-07-11T14:16:14,537 already explicitly excluding 'moleculekit.fileformats.binpos.src' via 2024-07-11T14:16:14,537 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,537 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,537 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,537 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,537 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,538 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,538 even if it does not contain any `.py` files. 2024-07-11T14:16:14,538 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,538 directory, all directories are treated like packages. 2024-07-11T14:16:14,538 ******************************************************************************** 2024-07-11T14:16:14,538 !! 2024-07-11T14:16:14,538 check.warn(importable) 2024-07-11T14:16:14,539 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.fileformats.dcd' is absent from the `packages` configuration. 2024-07-11T14:16:14,539 !! 2024-07-11T14:16:14,539 ******************************************************************************** 2024-07-11T14:16:14,539 ############################ 2024-07-11T14:16:14,539 # Package would be ignored # 2024-07-11T14:16:14,539 ############################ 2024-07-11T14:16:14,539 Python recognizes 'moleculekit.fileformats.dcd' as an importable package[^1], 2024-07-11T14:16:14,539 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,540 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,540 package, please make sure that 'moleculekit.fileformats.dcd' is explicitly added 2024-07-11T14:16:14,540 to the `packages` configuration field. 2024-07-11T14:16:14,540 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,540 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,540 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,541 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,541 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,541 If you don't want 'moleculekit.fileformats.dcd' to be distributed and are 2024-07-11T14:16:14,541 already explicitly excluding 'moleculekit.fileformats.dcd' via 2024-07-11T14:16:14,541 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,541 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,541 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,542 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,542 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,542 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,542 even if it does not contain any `.py` files. 2024-07-11T14:16:14,542 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,542 directory, all directories are treated like packages. 2024-07-11T14:16:14,543 ******************************************************************************** 2024-07-11T14:16:14,543 !! 2024-07-11T14:16:14,543 check.warn(importable) 2024-07-11T14:16:14,543 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.fileformats.dcd.include' is absent from the `packages` configuration. 2024-07-11T14:16:14,543 !! 2024-07-11T14:16:14,543 ******************************************************************************** 2024-07-11T14:16:14,543 ############################ 2024-07-11T14:16:14,544 # Package would be ignored # 2024-07-11T14:16:14,544 ############################ 2024-07-11T14:16:14,544 Python recognizes 'moleculekit.fileformats.dcd.include' as an importable package[^1], 2024-07-11T14:16:14,544 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,544 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,544 package, please make sure that 'moleculekit.fileformats.dcd.include' is explicitly added 2024-07-11T14:16:14,544 to the `packages` configuration field. 2024-07-11T14:16:14,545 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,545 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,545 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,545 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,545 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,545 If you don't want 'moleculekit.fileformats.dcd.include' to be distributed and are 2024-07-11T14:16:14,545 already explicitly excluding 'moleculekit.fileformats.dcd.include' via 2024-07-11T14:16:14,546 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,546 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,546 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,546 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,546 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,547 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,547 even if it does not contain any `.py` files. 2024-07-11T14:16:14,547 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,547 directory, all directories are treated like packages. 2024-07-11T14:16:14,547 ******************************************************************************** 2024-07-11T14:16:14,547 !! 2024-07-11T14:16:14,548 check.warn(importable) 2024-07-11T14:16:14,548 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.fileformats.dcd.src' is absent from the `packages` configuration. 2024-07-11T14:16:14,548 !! 2024-07-11T14:16:14,548 ******************************************************************************** 2024-07-11T14:16:14,548 ############################ 2024-07-11T14:16:14,548 # Package would be ignored # 2024-07-11T14:16:14,548 ############################ 2024-07-11T14:16:14,549 Python recognizes 'moleculekit.fileformats.dcd.src' as an importable package[^1], 2024-07-11T14:16:14,549 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,549 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,549 package, please make sure that 'moleculekit.fileformats.dcd.src' is explicitly added 2024-07-11T14:16:14,549 to the `packages` configuration field. 2024-07-11T14:16:14,549 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,549 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,549 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,550 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,550 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,550 If you don't want 'moleculekit.fileformats.dcd.src' to be distributed and are 2024-07-11T14:16:14,550 already explicitly excluding 'moleculekit.fileformats.dcd.src' via 2024-07-11T14:16:14,550 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,550 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,551 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,551 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,551 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,551 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,551 even if it does not contain any `.py` files. 2024-07-11T14:16:14,551 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,552 directory, all directories are treated like packages. 2024-07-11T14:16:14,552 ******************************************************************************** 2024-07-11T14:16:14,552 !! 2024-07-11T14:16:14,552 check.warn(importable) 2024-07-11T14:16:14,552 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.fileformats.xtc' is absent from the `packages` configuration. 2024-07-11T14:16:14,552 !! 2024-07-11T14:16:14,552 ******************************************************************************** 2024-07-11T14:16:14,553 ############################ 2024-07-11T14:16:14,553 # Package would be ignored # 2024-07-11T14:16:14,553 ############################ 2024-07-11T14:16:14,553 Python recognizes 'moleculekit.fileformats.xtc' as an importable package[^1], 2024-07-11T14:16:14,553 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,553 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,553 package, please make sure that 'moleculekit.fileformats.xtc' is explicitly added 2024-07-11T14:16:14,553 to the `packages` configuration field. 2024-07-11T14:16:14,554 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,554 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,554 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,554 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,554 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,554 If you don't want 'moleculekit.fileformats.xtc' to be distributed and are 2024-07-11T14:16:14,555 already explicitly excluding 'moleculekit.fileformats.xtc' via 2024-07-11T14:16:14,555 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,555 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,555 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,555 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,555 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,556 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,556 even if it does not contain any `.py` files. 2024-07-11T14:16:14,556 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,556 directory, all directories are treated like packages. 2024-07-11T14:16:14,556 ******************************************************************************** 2024-07-11T14:16:14,556 !! 2024-07-11T14:16:14,556 check.warn(importable) 2024-07-11T14:16:14,557 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.fileformats.xtc.include' is absent from the `packages` configuration. 2024-07-11T14:16:14,557 !! 2024-07-11T14:16:14,557 ******************************************************************************** 2024-07-11T14:16:14,557 ############################ 2024-07-11T14:16:14,557 # Package would be ignored # 2024-07-11T14:16:14,557 ############################ 2024-07-11T14:16:14,557 Python recognizes 'moleculekit.fileformats.xtc.include' as an importable package[^1], 2024-07-11T14:16:14,557 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,558 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,558 package, please make sure that 'moleculekit.fileformats.xtc.include' is explicitly added 2024-07-11T14:16:14,558 to the `packages` configuration field. 2024-07-11T14:16:14,558 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,558 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,558 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,559 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,559 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,559 If you don't want 'moleculekit.fileformats.xtc.include' to be distributed and are 2024-07-11T14:16:14,559 already explicitly excluding 'moleculekit.fileformats.xtc.include' via 2024-07-11T14:16:14,559 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,559 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,559 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,560 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,560 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,560 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,560 even if it does not contain any `.py` files. 2024-07-11T14:16:14,560 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,560 directory, all directories are treated like packages. 2024-07-11T14:16:14,561 ******************************************************************************** 2024-07-11T14:16:14,561 !! 2024-07-11T14:16:14,561 check.warn(importable) 2024-07-11T14:16:14,561 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.fileformats.xtc.src' is absent from the `packages` configuration. 2024-07-11T14:16:14,561 !! 2024-07-11T14:16:14,561 ******************************************************************************** 2024-07-11T14:16:14,561 ############################ 2024-07-11T14:16:14,562 # Package would be ignored # 2024-07-11T14:16:14,562 ############################ 2024-07-11T14:16:14,562 Python recognizes 'moleculekit.fileformats.xtc.src' as an importable package[^1], 2024-07-11T14:16:14,562 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,562 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,562 package, please make sure that 'moleculekit.fileformats.xtc.src' is explicitly added 2024-07-11T14:16:14,562 to the `packages` configuration field. 2024-07-11T14:16:14,563 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,563 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,563 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,563 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,563 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,564 If you don't want 'moleculekit.fileformats.xtc.src' to be distributed and are 2024-07-11T14:16:14,564 already explicitly excluding 'moleculekit.fileformats.xtc.src' via 2024-07-11T14:16:14,564 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,564 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,564 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,564 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,564 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,565 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,565 even if it does not contain any `.py` files. 2024-07-11T14:16:14,565 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,565 directory, all directories are treated like packages. 2024-07-11T14:16:14,565 ******************************************************************************** 2024-07-11T14:16:14,565 !! 2024-07-11T14:16:14,565 check.warn(importable) 2024-07-11T14:16:14,566 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.interactions.cationpi' is absent from the `packages` configuration. 2024-07-11T14:16:14,566 !! 2024-07-11T14:16:14,566 ******************************************************************************** 2024-07-11T14:16:14,566 ############################ 2024-07-11T14:16:14,566 # Package would be ignored # 2024-07-11T14:16:14,566 ############################ 2024-07-11T14:16:14,566 Python recognizes 'moleculekit.interactions.cationpi' as an importable package[^1], 2024-07-11T14:16:14,567 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,567 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,567 package, please make sure that 'moleculekit.interactions.cationpi' is explicitly added 2024-07-11T14:16:14,567 to the `packages` configuration field. 2024-07-11T14:16:14,567 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,567 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,568 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,568 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,568 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,568 If you don't want 'moleculekit.interactions.cationpi' to be distributed and are 2024-07-11T14:16:14,568 already explicitly excluding 'moleculekit.interactions.cationpi' via 2024-07-11T14:16:14,568 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,569 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,569 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,569 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,569 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,570 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,570 even if it does not contain any `.py` files. 2024-07-11T14:16:14,570 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,570 directory, all directories are treated like packages. 2024-07-11T14:16:14,570 ******************************************************************************** 2024-07-11T14:16:14,570 !! 2024-07-11T14:16:14,570 check.warn(importable) 2024-07-11T14:16:14,571 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.interactions.hbonds' is absent from the `packages` configuration. 2024-07-11T14:16:14,571 !! 2024-07-11T14:16:14,571 ******************************************************************************** 2024-07-11T14:16:14,571 ############################ 2024-07-11T14:16:14,571 # Package would be ignored # 2024-07-11T14:16:14,571 ############################ 2024-07-11T14:16:14,571 Python recognizes 'moleculekit.interactions.hbonds' as an importable package[^1], 2024-07-11T14:16:14,572 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,572 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,572 package, please make sure that 'moleculekit.interactions.hbonds' is explicitly added 2024-07-11T14:16:14,572 to the `packages` configuration field. 2024-07-11T14:16:14,572 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,572 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,572 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,573 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,573 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,573 If you don't want 'moleculekit.interactions.hbonds' to be distributed and are 2024-07-11T14:16:14,573 already explicitly excluding 'moleculekit.interactions.hbonds' via 2024-07-11T14:16:14,573 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,574 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,574 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,574 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,574 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,575 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,575 even if it does not contain any `.py` files. 2024-07-11T14:16:14,575 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,575 directory, all directories are treated like packages. 2024-07-11T14:16:14,575 ******************************************************************************** 2024-07-11T14:16:14,575 !! 2024-07-11T14:16:14,575 check.warn(importable) 2024-07-11T14:16:14,576 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.interactions.pipi' is absent from the `packages` configuration. 2024-07-11T14:16:14,576 !! 2024-07-11T14:16:14,576 ******************************************************************************** 2024-07-11T14:16:14,576 ############################ 2024-07-11T14:16:14,576 # Package would be ignored # 2024-07-11T14:16:14,576 ############################ 2024-07-11T14:16:14,576 Python recognizes 'moleculekit.interactions.pipi' as an importable package[^1], 2024-07-11T14:16:14,577 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,577 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,577 package, please make sure that 'moleculekit.interactions.pipi' is explicitly added 2024-07-11T14:16:14,577 to the `packages` configuration field. 2024-07-11T14:16:14,577 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,577 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,578 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,578 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,578 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,578 If you don't want 'moleculekit.interactions.pipi' to be distributed and are 2024-07-11T14:16:14,578 already explicitly excluding 'moleculekit.interactions.pipi' via 2024-07-11T14:16:14,579 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,579 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,579 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,579 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,579 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,580 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,580 even if it does not contain any `.py` files. 2024-07-11T14:16:14,580 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,580 directory, all directories are treated like packages. 2024-07-11T14:16:14,580 ******************************************************************************** 2024-07-11T14:16:14,580 !! 2024-07-11T14:16:14,580 check.warn(importable) 2024-07-11T14:16:14,580 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.interactions.sigmahole' is absent from the `packages` configuration. 2024-07-11T14:16:14,581 !! 2024-07-11T14:16:14,581 ******************************************************************************** 2024-07-11T14:16:14,581 ############################ 2024-07-11T14:16:14,581 # Package would be ignored # 2024-07-11T14:16:14,581 ############################ 2024-07-11T14:16:14,581 Python recognizes 'moleculekit.interactions.sigmahole' as an importable package[^1], 2024-07-11T14:16:14,581 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,582 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,582 package, please make sure that 'moleculekit.interactions.sigmahole' is explicitly added 2024-07-11T14:16:14,582 to the `packages` configuration field. 2024-07-11T14:16:14,582 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,582 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,582 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,583 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,583 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,583 If you don't want 'moleculekit.interactions.sigmahole' to be distributed and are 2024-07-11T14:16:14,583 already explicitly excluding 'moleculekit.interactions.sigmahole' via 2024-07-11T14:16:14,583 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,583 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,584 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,584 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,584 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,584 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,584 even if it does not contain any `.py` files. 2024-07-11T14:16:14,585 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,585 directory, all directories are treated like packages. 2024-07-11T14:16:14,585 ******************************************************************************** 2024-07-11T14:16:14,586 !! 2024-07-11T14:16:14,593 check.warn(importable) 2024-07-11T14:16:14,593 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.occupancy_utils' is absent from the `packages` configuration. 2024-07-11T14:16:14,593 !! 2024-07-11T14:16:14,594 ******************************************************************************** 2024-07-11T14:16:14,594 ############################ 2024-07-11T14:16:14,594 # Package would be ignored # 2024-07-11T14:16:14,594 ############################ 2024-07-11T14:16:14,594 Python recognizes 'moleculekit.occupancy_utils' as an importable package[^1], 2024-07-11T14:16:14,594 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,595 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,595 package, please make sure that 'moleculekit.occupancy_utils' is explicitly added 2024-07-11T14:16:14,595 to the `packages` configuration field. 2024-07-11T14:16:14,595 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,595 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,595 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,595 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,596 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,596 If you don't want 'moleculekit.occupancy_utils' to be distributed and are 2024-07-11T14:16:14,596 already explicitly excluding 'moleculekit.occupancy_utils' via 2024-07-11T14:16:14,596 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,596 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,596 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,597 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,597 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,597 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,597 even if it does not contain any `.py` files. 2024-07-11T14:16:14,598 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,598 directory, all directories are treated like packages. 2024-07-11T14:16:14,598 ******************************************************************************** 2024-07-11T14:16:14,598 !! 2024-07-11T14:16:14,598 check.warn(importable) 2024-07-11T14:16:14,598 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.share' is absent from the `packages` configuration. 2024-07-11T14:16:14,598 !! 2024-07-11T14:16:14,599 ******************************************************************************** 2024-07-11T14:16:14,599 ############################ 2024-07-11T14:16:14,599 # Package would be ignored # 2024-07-11T14:16:14,599 ############################ 2024-07-11T14:16:14,599 Python recognizes 'moleculekit.share' as an importable package[^1], 2024-07-11T14:16:14,599 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,600 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,600 package, please make sure that 'moleculekit.share' is explicitly added 2024-07-11T14:16:14,600 to the `packages` configuration field. 2024-07-11T14:16:14,600 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,600 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,600 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,600 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,601 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,601 If you don't want 'moleculekit.share' to be distributed and are 2024-07-11T14:16:14,601 already explicitly excluding 'moleculekit.share' via 2024-07-11T14:16:14,601 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,601 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,601 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,601 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,602 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,602 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,602 even if it does not contain any `.py` files. 2024-07-11T14:16:14,602 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,602 directory, all directories are treated like packages. 2024-07-11T14:16:14,603 ******************************************************************************** 2024-07-11T14:16:14,603 !! 2024-07-11T14:16:14,603 check.warn(importable) 2024-07-11T14:16:14,603 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.share.atomselect' is absent from the `packages` configuration. 2024-07-11T14:16:14,603 !! 2024-07-11T14:16:14,603 ******************************************************************************** 2024-07-11T14:16:14,603 ############################ 2024-07-11T14:16:14,604 # Package would be ignored # 2024-07-11T14:16:14,604 ############################ 2024-07-11T14:16:14,604 Python recognizes 'moleculekit.share.atomselect' as an importable package[^1], 2024-07-11T14:16:14,604 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,604 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,604 package, please make sure that 'moleculekit.share.atomselect' is explicitly added 2024-07-11T14:16:14,604 to the `packages` configuration field. 2024-07-11T14:16:14,605 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,605 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,605 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,605 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,605 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,606 If you don't want 'moleculekit.share.atomselect' to be distributed and are 2024-07-11T14:16:14,606 already explicitly excluding 'moleculekit.share.atomselect' via 2024-07-11T14:16:14,606 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,606 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,606 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,606 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,607 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,607 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,607 even if it does not contain any `.py` files. 2024-07-11T14:16:14,607 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,607 directory, all directories are treated like packages. 2024-07-11T14:16:14,607 ******************************************************************************** 2024-07-11T14:16:14,608 !! 2024-07-11T14:16:14,608 check.warn(importable) 2024-07-11T14:16:14,608 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.share.pdb2pqr.residues' is absent from the `packages` configuration. 2024-07-11T14:16:14,608 !! 2024-07-11T14:16:14,608 ******************************************************************************** 2024-07-11T14:16:14,608 ############################ 2024-07-11T14:16:14,608 # Package would be ignored # 2024-07-11T14:16:14,609 ############################ 2024-07-11T14:16:14,609 Python recognizes 'moleculekit.share.pdb2pqr.residues' as an importable package[^1], 2024-07-11T14:16:14,609 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,609 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,609 package, please make sure that 'moleculekit.share.pdb2pqr.residues' is explicitly added 2024-07-11T14:16:14,609 to the `packages` configuration field. 2024-07-11T14:16:14,610 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,610 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,610 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,610 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,610 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,611 If you don't want 'moleculekit.share.pdb2pqr.residues' to be distributed and are 2024-07-11T14:16:14,611 already explicitly excluding 'moleculekit.share.pdb2pqr.residues' via 2024-07-11T14:16:14,611 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,611 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,611 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,611 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,612 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,612 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,612 even if it does not contain any `.py` files. 2024-07-11T14:16:14,612 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,612 directory, all directories are treated like packages. 2024-07-11T14:16:14,612 ******************************************************************************** 2024-07-11T14:16:14,613 !! 2024-07-11T14:16:14,613 check.warn(importable) 2024-07-11T14:16:14,613 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.tmalign' is absent from the `packages` configuration. 2024-07-11T14:16:14,613 !! 2024-07-11T14:16:14,613 ******************************************************************************** 2024-07-11T14:16:14,613 ############################ 2024-07-11T14:16:14,614 # Package would be ignored # 2024-07-11T14:16:14,614 ############################ 2024-07-11T14:16:14,614 Python recognizes 'moleculekit.tmalign' as an importable package[^1], 2024-07-11T14:16:14,614 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,614 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,614 package, please make sure that 'moleculekit.tmalign' is explicitly added 2024-07-11T14:16:14,614 to the `packages` configuration field. 2024-07-11T14:16:14,615 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,615 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,615 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,615 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,615 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,616 If you don't want 'moleculekit.tmalign' to be distributed and are 2024-07-11T14:16:14,616 already explicitly excluding 'moleculekit.tmalign' via 2024-07-11T14:16:14,616 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,616 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,616 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,616 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,617 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,617 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,617 even if it does not contain any `.py` files. 2024-07-11T14:16:14,617 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,617 directory, all directories are treated like packages. 2024-07-11T14:16:14,617 ******************************************************************************** 2024-07-11T14:16:14,618 !! 2024-07-11T14:16:14,618 check.warn(importable) 2024-07-11T14:16:14,618 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.tmalign.include' is absent from the `packages` configuration. 2024-07-11T14:16:14,618 !! 2024-07-11T14:16:14,618 ******************************************************************************** 2024-07-11T14:16:14,618 ############################ 2024-07-11T14:16:14,618 # Package would be ignored # 2024-07-11T14:16:14,619 ############################ 2024-07-11T14:16:14,619 Python recognizes 'moleculekit.tmalign.include' as an importable package[^1], 2024-07-11T14:16:14,619 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,619 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,619 package, please make sure that 'moleculekit.tmalign.include' is explicitly added 2024-07-11T14:16:14,619 to the `packages` configuration field. 2024-07-11T14:16:14,619 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,620 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,620 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,620 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,620 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,620 If you don't want 'moleculekit.tmalign.include' to be distributed and are 2024-07-11T14:16:14,620 already explicitly excluding 'moleculekit.tmalign.include' via 2024-07-11T14:16:14,621 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,621 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,621 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,621 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,621 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,622 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,622 even if it does not contain any `.py` files. 2024-07-11T14:16:14,622 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,622 directory, all directories are treated like packages. 2024-07-11T14:16:14,622 ******************************************************************************** 2024-07-11T14:16:14,623 !! 2024-07-11T14:16:14,623 check.warn(importable) 2024-07-11T14:16:14,623 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.tmalign.src' is absent from the `packages` configuration. 2024-07-11T14:16:14,623 !! 2024-07-11T14:16:14,623 ******************************************************************************** 2024-07-11T14:16:14,623 ############################ 2024-07-11T14:16:14,623 # Package would be ignored # 2024-07-11T14:16:14,624 ############################ 2024-07-11T14:16:14,624 Python recognizes 'moleculekit.tmalign.src' as an importable package[^1], 2024-07-11T14:16:14,624 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,624 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,624 package, please make sure that 'moleculekit.tmalign.src' is explicitly added 2024-07-11T14:16:14,624 to the `packages` configuration field. 2024-07-11T14:16:14,625 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,625 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,625 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,625 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,625 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,626 If you don't want 'moleculekit.tmalign.src' to be distributed and are 2024-07-11T14:16:14,626 already explicitly excluding 'moleculekit.tmalign.src' via 2024-07-11T14:16:14,626 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,626 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,626 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,627 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,627 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,627 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,627 even if it does not contain any `.py` files. 2024-07-11T14:16:14,627 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,628 directory, all directories are treated like packages. 2024-07-11T14:16:14,628 ******************************************************************************** 2024-07-11T14:16:14,628 !! 2024-07-11T14:16:14,628 check.warn(importable) 2024-07-11T14:16:14,628 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/setuptools/command/build_py.py:215: _Warning: Package 'moleculekit.wrapping' is absent from the `packages` configuration. 2024-07-11T14:16:14,628 !! 2024-07-11T14:16:14,629 ******************************************************************************** 2024-07-11T14:16:14,629 ############################ 2024-07-11T14:16:14,629 # Package would be ignored # 2024-07-11T14:16:14,629 ############################ 2024-07-11T14:16:14,629 Python recognizes 'moleculekit.wrapping' as an importable package[^1], 2024-07-11T14:16:14,629 but it is absent from setuptools' `packages` configuration. 2024-07-11T14:16:14,630 This leads to an ambiguous overall configuration. If you want to distribute this 2024-07-11T14:16:14,630 package, please make sure that 'moleculekit.wrapping' is explicitly added 2024-07-11T14:16:14,630 to the `packages` configuration field. 2024-07-11T14:16:14,630 Alternatively, you can also rely on setuptools' discovery methods 2024-07-11T14:16:14,630 (for example by using `find_namespace_packages(...)`/`find_namespace:` 2024-07-11T14:16:14,630 instead of `find_packages(...)`/`find:`). 2024-07-11T14:16:14,631 You can read more about "package discovery" on setuptools documentation page: 2024-07-11T14:16:14,631 - https://setuptools.pypa.io/en/latest/userguide/package_discovery.html 2024-07-11T14:16:14,631 If you don't want 'moleculekit.wrapping' to be distributed and are 2024-07-11T14:16:14,631 already explicitly excluding 'moleculekit.wrapping' via 2024-07-11T14:16:14,631 `find_namespace_packages(...)/find_namespace` or `find_packages(...)/find`, 2024-07-11T14:16:14,632 you can try to use `exclude_package_data`, or `include-package-data=False` in 2024-07-11T14:16:14,632 combination with a more fine grained `package-data` configuration. 2024-07-11T14:16:14,632 You can read more about "package data files" on setuptools documentation page: 2024-07-11T14:16:14,632 - https://setuptools.pypa.io/en/latest/userguide/datafiles.html 2024-07-11T14:16:14,633 [^1]: For Python, any directory (with suitable naming) can be imported, 2024-07-11T14:16:14,633 even if it does not contain any `.py` files. 2024-07-11T14:16:14,633 On the other hand, currently there is no concept of package data 2024-07-11T14:16:14,633 directory, all directories are treated like packages. 2024-07-11T14:16:14,633 ******************************************************************************** 2024-07-11T14:16:14,633 !! 2024-07-11T14:16:14,634 check.warn(importable) 2024-07-11T14:16:14,634 copying moleculekit/logging.ini -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:14,634 copying moleculekit/vmd_wrapper -> build/lib.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:14,634 creating build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-07-11T14:16:14,634 copying moleculekit/atomselect_utils/atomselect_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-07-11T14:16:14,634 copying moleculekit/atomselect_utils/atomselect_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-07-11T14:16:14,634 creating build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-07-11T14:16:14,634 copying moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-07-11T14:16:14,648 copying moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-07-11T14:16:14,650 creating build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-07-11T14:16:14,651 copying moleculekit/cython_utils/cython_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-07-11T14:16:14,680 copying moleculekit/cython_utils/cython_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-07-11T14:16:14,682 creating build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-07-11T14:16:14,683 copying moleculekit/distance_utils/distance_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-07-11T14:16:14,706 copying moleculekit/distance_utils/distance_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-07-11T14:16:14,708 creating build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-07-11T14:16:14,710 copying moleculekit/occupancy_utils/occupancy_utils.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-07-11T14:16:14,737 copying moleculekit/occupancy_utils/occupancy_utils.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-07-11T14:16:14,739 creating build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-07-11T14:16:14,740 copying moleculekit/share/ALA.cif -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-07-11T14:16:14,743 copying moleculekit/share/backbone.cif -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-07-11T14:16:14,746 copying moleculekit/share/opm_sequences.json -> build/lib.linux-armv7l-cpython-39/moleculekit/share 2024-07-11T14:16:14,948 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect 2024-07-11T14:16:14,949 copying moleculekit/share/atomselect/atomselect.json -> build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect 2024-07-11T14:16:14,951 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr 2024-07-11T14:16:14,952 creating build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,953 copying moleculekit/share/pdb2pqr/residues/.gitkeep -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,956 copying moleculekit/share/pdb2pqr/residues/004.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,959 copying moleculekit/share/pdb2pqr/residues/004.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,961 copying moleculekit/share/pdb2pqr/residues/03Y.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,964 copying moleculekit/share/pdb2pqr/residues/03Y.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,968 copying moleculekit/share/pdb2pqr/residues/0A1.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,970 copying moleculekit/share/pdb2pqr/residues/0A1.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,973 copying moleculekit/share/pdb2pqr/residues/0AF.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,975 copying moleculekit/share/pdb2pqr/residues/0AF.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,979 copying moleculekit/share/pdb2pqr/residues/0BN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,981 copying moleculekit/share/pdb2pqr/residues/0BN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,984 copying moleculekit/share/pdb2pqr/residues/1MH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,987 copying moleculekit/share/pdb2pqr/residues/1MH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,990 copying moleculekit/share/pdb2pqr/residues/2AS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,993 copying moleculekit/share/pdb2pqr/residues/2AS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,996 copying moleculekit/share/pdb2pqr/residues/2GX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:14,998 copying moleculekit/share/pdb2pqr/residues/2GX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,001 copying moleculekit/share/pdb2pqr/residues/2ML.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,003 copying moleculekit/share/pdb2pqr/residues/2ML.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,007 copying moleculekit/share/pdb2pqr/residues/2MR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,009 copying moleculekit/share/pdb2pqr/residues/2MR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,013 copying moleculekit/share/pdb2pqr/residues/4IN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,015 copying moleculekit/share/pdb2pqr/residues/4IN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,018 copying moleculekit/share/pdb2pqr/residues/4PH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,020 copying moleculekit/share/pdb2pqr/residues/4PH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,024 copying moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,026 copying moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,029 copying moleculekit/share/pdb2pqr/residues/5JP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,031 copying moleculekit/share/pdb2pqr/residues/5JP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,034 copying moleculekit/share/pdb2pqr/residues/AA4.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,037 copying moleculekit/share/pdb2pqr/residues/AA4.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,040 copying moleculekit/share/pdb2pqr/residues/ABA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,042 copying moleculekit/share/pdb2pqr/residues/ABA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,046 copying moleculekit/share/pdb2pqr/residues/AHP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,048 copying moleculekit/share/pdb2pqr/residues/AHP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,051 copying moleculekit/share/pdb2pqr/residues/ALC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,054 copying moleculekit/share/pdb2pqr/residues/ALC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,056 copying moleculekit/share/pdb2pqr/residues/ALN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,058 copying moleculekit/share/pdb2pqr/residues/ALN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,061 copying moleculekit/share/pdb2pqr/residues/ALY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,063 copying moleculekit/share/pdb2pqr/residues/ALY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,065 copying moleculekit/share/pdb2pqr/residues/APD.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,067 copying moleculekit/share/pdb2pqr/residues/APD.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,069 copying moleculekit/share/pdb2pqr/residues/BB8.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,072 copying moleculekit/share/pdb2pqr/residues/BB8.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,074 copying moleculekit/share/pdb2pqr/residues/BCS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,076 copying moleculekit/share/pdb2pqr/residues/BCS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,079 copying moleculekit/share/pdb2pqr/residues/BTK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,081 copying moleculekit/share/pdb2pqr/residues/BTK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,084 copying moleculekit/share/pdb2pqr/residues/CCS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,085 copying moleculekit/share/pdb2pqr/residues/CCS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,088 copying moleculekit/share/pdb2pqr/residues/CGU.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,090 copying moleculekit/share/pdb2pqr/residues/CGU.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,093 copying moleculekit/share/pdb2pqr/residues/CSA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,095 copying moleculekit/share/pdb2pqr/residues/CSA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,098 copying moleculekit/share/pdb2pqr/residues/CSO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,099 copying moleculekit/share/pdb2pqr/residues/CSO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,102 copying moleculekit/share/pdb2pqr/residues/CSP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,105 copying moleculekit/share/pdb2pqr/residues/CSP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,107 copying moleculekit/share/pdb2pqr/residues/CSS.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,109 copying moleculekit/share/pdb2pqr/residues/CSS.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,111 copying moleculekit/share/pdb2pqr/residues/D4P.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,113 copying moleculekit/share/pdb2pqr/residues/D4P.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,116 copying moleculekit/share/pdb2pqr/residues/DA2.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,118 copying moleculekit/share/pdb2pqr/residues/DA2.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,121 copying moleculekit/share/pdb2pqr/residues/DAB.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,123 copying moleculekit/share/pdb2pqr/residues/DAB.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,856 copying moleculekit/share/pdb2pqr/residues/DAH.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,860 copying moleculekit/share/pdb2pqr/residues/DAH.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,864 copying moleculekit/share/pdb2pqr/residues/DPP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,869 copying moleculekit/share/pdb2pqr/residues/DPP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,874 copying moleculekit/share/pdb2pqr/residues/ESC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,878 copying moleculekit/share/pdb2pqr/residues/ESC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,882 copying moleculekit/share/pdb2pqr/residues/FGL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,886 copying moleculekit/share/pdb2pqr/residues/FGL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,890 copying moleculekit/share/pdb2pqr/residues/GHG.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,895 copying moleculekit/share/pdb2pqr/residues/GHG.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,899 copying moleculekit/share/pdb2pqr/residues/GME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,903 copying moleculekit/share/pdb2pqr/residues/GME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,907 copying moleculekit/share/pdb2pqr/residues/GNC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,916 copying moleculekit/share/pdb2pqr/residues/GNC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,920 copying moleculekit/share/pdb2pqr/residues/HHK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,924 copying moleculekit/share/pdb2pqr/residues/HHK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,929 copying moleculekit/share/pdb2pqr/residues/HLU.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,933 copying moleculekit/share/pdb2pqr/residues/HLU.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,945 copying moleculekit/share/pdb2pqr/residues/HLX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,949 copying moleculekit/share/pdb2pqr/residues/HLX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,953 copying moleculekit/share/pdb2pqr/residues/HOX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,957 copying moleculekit/share/pdb2pqr/residues/HOX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,968 copying moleculekit/share/pdb2pqr/residues/HPE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,972 copying moleculekit/share/pdb2pqr/residues/HPE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,975 copying moleculekit/share/pdb2pqr/residues/HQA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,979 copying moleculekit/share/pdb2pqr/residues/HQA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,983 copying moleculekit/share/pdb2pqr/residues/HTR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,986 copying moleculekit/share/pdb2pqr/residues/HTR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,990 copying moleculekit/share/pdb2pqr/residues/HYP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,994 copying moleculekit/share/pdb2pqr/residues/HYP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:15,997 copying moleculekit/share/pdb2pqr/residues/I2M.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,001 copying moleculekit/share/pdb2pqr/residues/I2M.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,004 copying moleculekit/share/pdb2pqr/residues/IGL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,009 copying moleculekit/share/pdb2pqr/residues/IGL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,012 copying moleculekit/share/pdb2pqr/residues/IIL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,015 copying moleculekit/share/pdb2pqr/residues/IIL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,019 copying moleculekit/share/pdb2pqr/residues/IML.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,023 copying moleculekit/share/pdb2pqr/residues/IML.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,027 copying moleculekit/share/pdb2pqr/residues/KYN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,031 copying moleculekit/share/pdb2pqr/residues/KYN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,034 copying moleculekit/share/pdb2pqr/residues/LME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,037 copying moleculekit/share/pdb2pqr/residues/LME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,041 copying moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,044 copying moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,048 copying moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,051 copying moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,055 copying moleculekit/share/pdb2pqr/residues/M3L.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,059 copying moleculekit/share/pdb2pqr/residues/M3L.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,062 copying moleculekit/share/pdb2pqr/residues/ME0.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,066 copying moleculekit/share/pdb2pqr/residues/ME0.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,070 copying moleculekit/share/pdb2pqr/residues/MEA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,073 copying moleculekit/share/pdb2pqr/residues/MEA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,076 copying moleculekit/share/pdb2pqr/residues/MEN.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,080 copying moleculekit/share/pdb2pqr/residues/MEN.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,083 copying moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,087 copying moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,090 copying moleculekit/share/pdb2pqr/residues/MLE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,094 copying moleculekit/share/pdb2pqr/residues/MLE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,097 copying moleculekit/share/pdb2pqr/residues/MLY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,100 copying moleculekit/share/pdb2pqr/residues/MLY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,104 copying moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,108 copying moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,117 copying moleculekit/share/pdb2pqr/residues/MME.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,120 copying moleculekit/share/pdb2pqr/residues/MME.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,125 copying moleculekit/share/pdb2pqr/residues/MMO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,128 copying moleculekit/share/pdb2pqr/residues/MMO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,131 copying moleculekit/share/pdb2pqr/residues/MVA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,135 copying moleculekit/share/pdb2pqr/residues/MVA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,138 copying moleculekit/share/pdb2pqr/residues/NAL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,142 copying moleculekit/share/pdb2pqr/residues/NAL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,145 copying moleculekit/share/pdb2pqr/residues/NCY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,148 copying moleculekit/share/pdb2pqr/residues/NCY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,151 copying moleculekit/share/pdb2pqr/residues/NLE.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,155 copying moleculekit/share/pdb2pqr/residues/NLE.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,165 copying moleculekit/share/pdb2pqr/residues/NVA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,168 copying moleculekit/share/pdb2pqr/residues/NVA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,172 copying moleculekit/share/pdb2pqr/residues/NZC.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,175 copying moleculekit/share/pdb2pqr/residues/NZC.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,178 copying moleculekit/share/pdb2pqr/residues/OCY.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,181 copying moleculekit/share/pdb2pqr/residues/OCY.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,185 copying moleculekit/share/pdb2pqr/residues/OMX.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,189 copying moleculekit/share/pdb2pqr/residues/OMX.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,193 copying moleculekit/share/pdb2pqr/residues/ONL.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,196 copying moleculekit/share/pdb2pqr/residues/ONL.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,200 copying moleculekit/share/pdb2pqr/residues/ORM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,203 copying moleculekit/share/pdb2pqr/residues/ORM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,206 copying moleculekit/share/pdb2pqr/residues/P1L.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,210 copying moleculekit/share/pdb2pqr/residues/P1L.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,214 copying moleculekit/share/pdb2pqr/residues/PCA.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,217 copying moleculekit/share/pdb2pqr/residues/PCA.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,220 copying moleculekit/share/pdb2pqr/residues/PRK.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,223 copying moleculekit/share/pdb2pqr/residues/PRK.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,228 copying moleculekit/share/pdb2pqr/residues/PTR.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,231 copying moleculekit/share/pdb2pqr/residues/PTR.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,234 copying moleculekit/share/pdb2pqr/residues/SEP.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,238 copying moleculekit/share/pdb2pqr/residues/SEP.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,241 copying moleculekit/share/pdb2pqr/residues/TPO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,244 copying moleculekit/share/pdb2pqr/residues/TPO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,247 copying moleculekit/share/pdb2pqr/residues/TRO.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,251 copying moleculekit/share/pdb2pqr/residues/TRO.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,254 copying moleculekit/share/pdb2pqr/residues/TY2.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,258 copying moleculekit/share/pdb2pqr/residues/TY2.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,261 copying moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,264 copying moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,268 copying moleculekit/share/pdb2pqr/residues/YCM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,272 copying moleculekit/share/pdb2pqr/residues/YCM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,275 copying moleculekit/share/pdb2pqr/residues/YNM.dat -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,278 copying moleculekit/share/pdb2pqr/residues/YNM.xml -> build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues 2024-07-11T14:16:16,282 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-07-11T14:16:16,283 copying moleculekit/tmalign/tmalign_util.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-07-11T14:16:16,314 copying moleculekit/tmalign/tmalign_util.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-07-11T14:16:16,318 copying moleculekit/tmalign/tmalignlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign 2024-07-11T14:16:16,320 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include 2024-07-11T14:16:16,322 copying moleculekit/tmalign/include/TMAlign.h -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include 2024-07-11T14:16:16,325 creating build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-07-11T14:16:16,326 copying moleculekit/tmalign/src/TMAlign.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-07-11T14:16:16,355 creating build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-07-11T14:16:16,356 copying moleculekit/wrapping/wrapping.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-07-11T14:16:16,389 copying moleculekit/wrapping/wrapping.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/wrapping 2024-07-11T14:16:16,392 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-07-11T14:16:16,394 copying moleculekit/fileformats/binpos/binpos.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-07-11T14:16:16,419 copying moleculekit/fileformats/binpos/binpos.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-07-11T14:16:16,423 copying moleculekit/fileformats/binpos/binposlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-07-11T14:16:16,426 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-07-11T14:16:16,428 copying moleculekit/fileformats/binpos/include/binposplugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-07-11T14:16:16,432 copying moleculekit/fileformats/binpos/include/largefiles.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-07-11T14:16:16,436 copying moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include 2024-07-11T14:16:16,441 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-07-11T14:16:16,453 copying moleculekit/fileformats/binpos/src/binposplugin.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-07-11T14:16:16,458 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-07-11T14:16:16,460 copying moleculekit/fileformats/dcd/dcd.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-07-11T14:16:16,481 copying moleculekit/fileformats/dcd/dcd.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-07-11T14:16:16,485 copying moleculekit/fileformats/dcd/dcdlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-07-11T14:16:16,488 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-07-11T14:16:16,489 copying moleculekit/fileformats/dcd/include/dcdplugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-07-11T14:16:16,493 copying moleculekit/fileformats/dcd/include/endianswap.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-07-11T14:16:16,496 copying moleculekit/fileformats/dcd/include/fastio.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-07-11T14:16:16,500 copying moleculekit/fileformats/dcd/include/largefiles.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-07-11T14:16:16,502 copying moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include 2024-07-11T14:16:16,506 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-07-11T14:16:16,507 copying moleculekit/fileformats/dcd/src/dcdplugin.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-07-11T14:16:16,512 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-07-11T14:16:16,513 copying moleculekit/fileformats/xtc/trr.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-07-11T14:16:16,546 copying moleculekit/fileformats/xtc/trr.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-07-11T14:16:16,550 copying moleculekit/fileformats/xtc/trrlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-07-11T14:16:16,553 copying moleculekit/fileformats/xtc/xdrlib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-07-11T14:16:16,556 copying moleculekit/fileformats/xtc/xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-07-11T14:16:16,588 copying moleculekit/fileformats/xtc/xtc.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-07-11T14:16:16,590 copying moleculekit/fileformats/xtc/xtclib.pxd -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-07-11T14:16:16,592 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-07-11T14:16:16,593 copying moleculekit/fileformats/xtc/include/trr_header.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-07-11T14:16:16,595 copying moleculekit/fileformats/xtc/include/xdr_seek.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-07-11T14:16:16,598 copying moleculekit/fileformats/xtc/include/xdrfile.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-07-11T14:16:16,601 copying moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-07-11T14:16:16,603 copying moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-07-11T14:16:16,606 copying moleculekit/fileformats/xtc/include/xtc.h -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include 2024-07-11T14:16:16,608 creating build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-07-11T14:16:16,609 copying moleculekit/fileformats/xtc/src/xdr_seek.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-07-11T14:16:16,612 copying moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-07-11T14:16:16,616 copying moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-07-11T14:16:16,619 copying moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-07-11T14:16:16,621 copying moleculekit/fileformats/xtc/src/xtc.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-07-11T14:16:16,624 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-07-11T14:16:16,626 copying moleculekit/interactions/cationpi/cationpi.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-07-11T14:16:16,658 copying moleculekit/interactions/cationpi/cationpi.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-07-11T14:16:16,661 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-07-11T14:16:16,662 copying moleculekit/interactions/hbonds/hbonds.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-07-11T14:16:16,688 copying moleculekit/interactions/hbonds/hbonds.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-07-11T14:16:16,691 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-07-11T14:16:16,692 copying moleculekit/interactions/pipi/pipi.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-07-11T14:16:16,719 copying moleculekit/interactions/pipi/pipi.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-07-11T14:16:16,721 creating build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-07-11T14:16:16,723 copying moleculekit/interactions/sigmahole/sigmahole.cpp -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-07-11T14:16:16,754 copying moleculekit/interactions/sigmahole/sigmahole.pyx -> build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-07-11T14:16:16,768 UPDATING build/lib.linux-armv7l-cpython-39/moleculekit/_version.py 2024-07-11T14:16:16,768 set build/lib.linux-armv7l-cpython-39/moleculekit/_version.py to '1.9.1' 2024-07-11T14:16:16,768 running build_ext 2024-07-11T14:16:16,987 building 'moleculekit.interactions.hbonds' extension 2024-07-11T14:16:17,206 creating build/temp.linux-armv7l-cpython-39 2024-07-11T14:16:17,414 creating build/temp.linux-armv7l-cpython-39/moleculekit 2024-07-11T14:16:17,604 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions 2024-07-11T14:16:17,697 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/hbonds 2024-07-11T14:16:17,970 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-k7hm872d/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 2024-07-11T14:16:18,757 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:16:18,757 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:16:18,757 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:16:18,758 from moleculekit/interactions/hbonds/hbonds.cpp:1265: 2024-07-11T14:16:18,758 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:16:18,758 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:16:18,758 | ^~~~~~~ 2024-07-11T14:16:19,220 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ufuncobject.h:4, 2024-07-11T14:16:19,220 from moleculekit/interactions/hbonds/hbonds.cpp:1269: 2024-07-11T14:16:19,220 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h: In function ‘npy_longdouble npy_creall(npy_clongdouble)’: 2024-07-11T14:16:19,221 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h:405:13: warning: dereferencing type-punned pointer will break strict-aliasing rules [-Wstrict-aliasing] 2024-07-11T14:16:19,221 405 | return ((longdouble_t *) &z)[0]; 2024-07-11T14:16:19,221 | ~^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:16:41,852 moleculekit/interactions/hbonds/hbonds.cpp: In function ‘PyObject* __pyx_pw_11moleculekit_12interactions_6hbonds_1calculate(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-07-11T14:16:41,852 moleculekit/interactions/hbonds/hbonds.cpp:21469:52: warning: ‘__pyx_v_d_idx_h’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:16:41,853 21469 | (__pyx_v_results[__pyx_v_f]).push_back(__pyx_v_d_idx_h); 2024-07-11T14:16:41,853 | ^~~~~~~~~~~~~~~ 2024-07-11T14:16:41,853 moleculekit/interactions/hbonds/hbonds.cpp:20486:57: note: ‘__pyx_v_d_idx_h’ was declared here 2024-07-11T14:16:41,853 20486 | __pyx_t_11moleculekit_12interactions_6hbonds_UINT32_t __pyx_v_d_idx_h; 2024-07-11T14:16:41,853 | ^~~~~~~~~~~~~~~ 2024-07-11T14:16:45,030 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 2024-07-11T14:16:45,359 building 'moleculekit.interactions.pipi' extension 2024-07-11T14:16:45,360 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/pipi 2024-07-11T14:16:45,362 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-k7hm872d/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 2024-07-11T14:16:45,630 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:16:45,630 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:16:45,630 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:16:45,630 from moleculekit/interactions/pipi/pipi.cpp:1265: 2024-07-11T14:16:45,631 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:16:45,631 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:16:45,631 | ^~~~~~~ 2024-07-11T14:16:46,073 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ufuncobject.h:4, 2024-07-11T14:16:46,073 from moleculekit/interactions/pipi/pipi.cpp:1269: 2024-07-11T14:16:46,073 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h: In function ‘npy_longdouble npy_creall(npy_clongdouble)’: 2024-07-11T14:16:46,073 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h:405:13: warning: dereferencing type-punned pointer will break strict-aliasing rules [-Wstrict-aliasing] 2024-07-11T14:16:46,073 405 | return ((longdouble_t *) &z)[0]; 2024-07-11T14:16:46,074 | ~^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:17:14,006 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 2024-07-11T14:17:14,329 building 'moleculekit.interactions.cationpi' extension 2024-07-11T14:17:14,330 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/cationpi 2024-07-11T14:17:14,331 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-k7hm872d/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 2024-07-11T14:17:14,588 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:17:14,589 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:17:14,589 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:17:14,589 from moleculekit/interactions/cationpi/cationpi.cpp:1265: 2024-07-11T14:17:14,589 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:17:14,589 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:17:14,589 | ^~~~~~~ 2024-07-11T14:17:15,058 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ufuncobject.h:4, 2024-07-11T14:17:15,058 from moleculekit/interactions/cationpi/cationpi.cpp:1269: 2024-07-11T14:17:15,058 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h: In function ‘npy_longdouble npy_creall(npy_clongdouble)’: 2024-07-11T14:17:15,058 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h:405:13: warning: dereferencing type-punned pointer will break strict-aliasing rules [-Wstrict-aliasing] 2024-07-11T14:17:15,059 405 | return ((longdouble_t *) &z)[0]; 2024-07-11T14:17:15,059 | ~^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:17:44,562 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 2024-07-11T14:17:44,911 building 'moleculekit.interactions.sigmahole' extension 2024-07-11T14:17:44,912 creating build/temp.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole 2024-07-11T14:17:44,913 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-k7hm872d/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 2024-07-11T14:17:45,175 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:17:45,175 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:17:45,175 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:17:45,175 from moleculekit/interactions/sigmahole/sigmahole.cpp:1265: 2024-07-11T14:17:45,176 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:17:45,176 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:17:45,176 | ^~~~~~~ 2024-07-11T14:17:45,624 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ufuncobject.h:4, 2024-07-11T14:17:45,624 from moleculekit/interactions/sigmahole/sigmahole.cpp:1269: 2024-07-11T14:17:45,625 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h: In function ‘npy_longdouble npy_creall(npy_clongdouble)’: 2024-07-11T14:17:45,625 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h:405:13: warning: dereferencing type-punned pointer will break strict-aliasing rules [-Wstrict-aliasing] 2024-07-11T14:17:45,625 405 | return ((longdouble_t *) &z)[0]; 2024-07-11T14:17:45,625 | ~^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:12,652 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 2024-07-11T14:18:12,971 building 'moleculekit.wrapping' extension 2024-07-11T14:18:12,972 creating build/temp.linux-armv7l-cpython-39/moleculekit/wrapping 2024-07-11T14:18:12,973 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-k7hm872d/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 2024-07-11T14:18:13,229 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:18:13,229 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:18:13,229 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:18:13,229 from moleculekit/wrapping/wrapping.cpp:1265: 2024-07-11T14:18:13,229 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:18:13,229 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:18:13,230 | ^~~~~~~ 2024-07-11T14:18:13,673 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ufuncobject.h:4, 2024-07-11T14:18:13,673 from moleculekit/wrapping/wrapping.cpp:1269: 2024-07-11T14:18:13,673 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h: In function ‘npy_longdouble npy_creall(npy_clongdouble)’: 2024-07-11T14:18:13,673 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h:405:13: warning: dereferencing type-punned pointer will break strict-aliasing rules [-Wstrict-aliasing] 2024-07-11T14:18:13,673 405 | return ((longdouble_t *) &z)[0]; 2024-07-11T14:18:13,674 | ~^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:39,152 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 2024-07-11T14:18:39,369 building 'moleculekit.bondguesser_utils' extension 2024-07-11T14:18:39,370 creating build/temp.linux-armv7l-cpython-39/moleculekit/bondguesser_utils 2024-07-11T14:18:39,371 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-k7hm872d/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 2024-07-11T14:18:39,623 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:18:39,624 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:18:39,624 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:18:39,624 from moleculekit/bondguesser_utils/bondguesser_utils.cpp:1265: 2024-07-11T14:18:39,624 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:18:39,624 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:18:39,624 | ^~~~~~~ 2024-07-11T14:18:40,063 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ufuncobject.h:4, 2024-07-11T14:18:40,063 from moleculekit/bondguesser_utils/bondguesser_utils.cpp:1269: 2024-07-11T14:18:40,063 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h: In function ‘npy_longdouble npy_creall(npy_clongdouble)’: 2024-07-11T14:18:40,063 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h:405:13: warning: dereferencing type-punned pointer will break strict-aliasing rules [-Wstrict-aliasing] 2024-07-11T14:18:40,063 405 | return ((longdouble_t *) &z)[0]; 2024-07-11T14:18:40,064 | ~^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,182 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)’: 2024-07-11T14:18:41,182 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20255:33: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-07-11T14:18:41,182 20255 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-07-11T14:18:41,183 | ~~~~~~~~~~^~~~~~~~~~~ 2024-07-11T14:18:41,183 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20267:35: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-07-11T14:18:41,183 20267 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-07-11T14:18:41,183 | ~~~~~~~~~~^~~~~~~~~~~ 2024-07-11T14:18:41,183 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20279:37: warning: comparison of integer expressions of different signedness: ‘int’ and ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} [-Wsign-compare] 2024-07-11T14:18:41,183 20279 | for (__pyx_t_9 = 0; __pyx_t_9 < __pyx_t_8; __pyx_t_9+=1) { 2024-07-11T14:18:41,183 | ~~~~~~~~~~^~~~~~~~~~~ 2024-07-11T14:18:41,184 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20318:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,184 20318 | __pyx_t_12 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-07-11T14:18:41,184 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,184 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20357:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,184 20357 | __pyx_t_12 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-07-11T14:18:41,184 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,184 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20396:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,185 20396 | __pyx_t_12 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-07-11T14:18:41,185 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,185 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20435:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,185 20435 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-07-11T14:18:41,185 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,185 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20441:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,185 20441 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-07-11T14:18:41,186 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,186 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20482:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,186 20482 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-07-11T14:18:41,186 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,186 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20488:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,186 20488 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-07-11T14:18:41,187 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,187 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20529:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,187 20529 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-07-11T14:18:41,187 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,187 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20535:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,187 20535 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-07-11T14:18:41,187 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,187 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20576:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,188 20576 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-07-11T14:18:41,188 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,188 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20629:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,188 20629 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-07-11T14:18:41,188 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,188 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20676:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,188 20676 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-07-11T14:18:41,189 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,189 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20717:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,189 20717 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-07-11T14:18:41,189 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,189 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20723:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,189 20723 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-07-11T14:18:41,189 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,190 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20729:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,190 20729 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-07-11T14:18:41,190 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,190 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20776:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,190 20776 | __pyx_t_13 = (__pyx_v_yi < (__pyx_v_yboxes - 1)); 2024-07-11T14:18:41,190 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,190 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20782:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,191 20782 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-07-11T14:18:41,191 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,191 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20823:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,191 20823 | __pyx_t_13 = (__pyx_v_xi < (__pyx_v_xboxes - 1)); 2024-07-11T14:18:41,191 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,191 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20835:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,191 20835 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-07-11T14:18:41,192 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,192 moleculekit/bondguesser_utils/bondguesser_utils.cpp:20888:34: warning: comparison of integer expressions of different signedness: ‘int’ and ‘long unsigned int’ [-Wsign-compare] 2024-07-11T14:18:41,192 20888 | __pyx_t_13 = (__pyx_v_zi < (__pyx_v_zboxes - 1)); 2024-07-11T14:18:41,192 | ~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,211 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)’: 2024-07-11T14:18:41,211 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21510:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-07-11T14:18:41,211 21510 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_n_boxes); 2024-07-11T14:18:41,211 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~ 2024-07-11T14:18:41,212 moleculekit/bondguesser_utils/bondguesser_utils.cpp:21547:37: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_17bondguesser_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-07-11T14:18:41,212 21547 | __pyx_t_6 = (__pyx_v_boxneigh == __pyx_v_boxidx); 2024-07-11T14:18:41,212 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-07-11T14:19:04,289 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 2024-07-11T14:19:04,602 building 'moleculekit.atomselect_utils' extension 2024-07-11T14:19:04,603 creating build/temp.linux-armv7l-cpython-39/moleculekit/atomselect_utils 2024-07-11T14:19:04,604 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-k7hm872d/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 2024-07-11T14:19:04,896 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:19:04,896 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:19:04,896 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:19:04,897 from moleculekit/atomselect_utils/atomselect_utils.cpp:1282: 2024-07-11T14:19:04,897 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:19:04,897 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:19:04,897 | ^~~~~~~ 2024-07-11T14:19:05,353 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ufuncobject.h:4, 2024-07-11T14:19:05,353 from moleculekit/atomselect_utils/atomselect_utils.cpp:1286: 2024-07-11T14:19:05,353 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h: In function ‘npy_longdouble npy_creall(npy_clongdouble)’: 2024-07-11T14:19:05,353 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h:405:13: warning: dereferencing type-punned pointer will break strict-aliasing rules [-Wstrict-aliasing] 2024-07-11T14:19:05,354 405 | return ((longdouble_t *) &z)[0]; 2024-07-11T14:19:05,354 | ~^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:19:06,613 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 >&)’: 2024-07-11T14:19:06,613 moleculekit/atomselect_utils/atomselect_utils.cpp:23709:161: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-07-11T14:19:06,614 23709 | __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); 2024-07-11T14:19:06,614 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~ 2024-07-11T14:19:06,619 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 >&)’: 2024-07-11T14:19:06,619 moleculekit/atomselect_utils/atomselect_utils.cpp:23961:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-07-11T14:19:06,619 23961 | __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); 2024-07-11T14:19:06,619 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-07-11T14:19:06,624 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 >&)’: 2024-07-11T14:19:06,624 moleculekit/atomselect_utils/atomselect_utils.cpp:24228:163: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_16atomselect_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-07-11T14:19:06,624 24228 | __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); 2024-07-11T14:19:06,625 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-07-11T14:19:36,803 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 2024-07-11T14:19:37,138 building 'moleculekit.distance_utils' extension 2024-07-11T14:19:37,139 creating build/temp.linux-armv7l-cpython-39/moleculekit/distance_utils 2024-07-11T14:19:37,140 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-k7hm872d/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 2024-07-11T14:19:37,374 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:19:37,374 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:19:37,374 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:19:37,374 from moleculekit/distance_utils/distance_utils.cpp:1265: 2024-07-11T14:19:37,375 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:19:37,375 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:19:37,375 | ^~~~~~~ 2024-07-11T14:19:37,860 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ufuncobject.h:4, 2024-07-11T14:19:37,860 from moleculekit/distance_utils/distance_utils.cpp:1269: 2024-07-11T14:19:37,860 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h: In function ‘npy_longdouble npy_creall(npy_clongdouble)’: 2024-07-11T14:19:37,860 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h:405:13: warning: dereferencing type-punned pointer will break strict-aliasing rules [-Wstrict-aliasing] 2024-07-11T14:19:37,860 405 | return ((longdouble_t *) &z)[0]; 2024-07-11T14:19:37,860 | ~^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:19:39,042 moleculekit/distance_utils/distance_utils.cpp: In function ‘PyObject* __pyx_pf_11moleculekit_14distance_utils_2get_collisions(PyObject*, __Pyx_memviewslice, __Pyx_memviewslice, float)’: 2024-07-11T14:19:39,042 moleculekit/distance_utils/distance_utils.cpp:21813:33: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_14distance_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-07-11T14:19:39,042 21813 | for (__pyx_t_3 = 0; __pyx_t_3 < __pyx_t_2; __pyx_t_3+=1) { 2024-07-11T14:19:39,042 | ~~~~~~~~~~^~~~~~~~~~~ 2024-07-11T14:19:39,042 moleculekit/distance_utils/distance_utils.cpp:21825:35: warning: comparison of integer expressions of different signedness: ‘__pyx_t_11moleculekit_14distance_utils_UINT32_t’ {aka ‘long unsigned int’} and ‘int’ [-Wsign-compare] 2024-07-11T14:19:39,043 21825 | for (__pyx_t_6 = 0; __pyx_t_6 < __pyx_t_5; __pyx_t_6+=1) { 2024-07-11T14:19:39,043 | ~~~~~~~~~~^~~~~~~~~~~ 2024-07-11T14:20:12,092 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 2024-07-11T14:20:12,436 building 'moleculekit.occupancy_utils' extension 2024-07-11T14:20:12,437 creating build/temp.linux-armv7l-cpython-39/moleculekit/occupancy_utils 2024-07-11T14:20:12,438 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-k7hm872d/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 2024-07-11T14:20:12,679 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:20:12,680 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:20:12,680 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:20:12,680 from moleculekit/occupancy_utils/occupancy_utils.cpp:1265: 2024-07-11T14:20:12,680 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:20:12,680 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:20:12,680 | ^~~~~~~ 2024-07-11T14:20:13,115 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ufuncobject.h:4, 2024-07-11T14:20:13,115 from moleculekit/occupancy_utils/occupancy_utils.cpp:1269: 2024-07-11T14:20:13,115 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h: In function ‘npy_longdouble npy_creall(npy_clongdouble)’: 2024-07-11T14:20:13,116 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h:405:13: warning: dereferencing type-punned pointer will break strict-aliasing rules [-Wstrict-aliasing] 2024-07-11T14:20:13,116 405 | return ((longdouble_t *) &z)[0]; 2024-07-11T14:20:13,116 | ~^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:20:35,794 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 2024-07-11T14:20:36,004 building 'moleculekit.cython_utils' extension 2024-07-11T14:20:36,005 creating build/temp.linux-armv7l-cpython-39/moleculekit/cython_utils 2024-07-11T14:20:36,006 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-k7hm872d/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 2024-07-11T14:20:36,245 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:20:36,245 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:20:36,246 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:20:36,246 from moleculekit/cython_utils/cython_utils.cpp:1265: 2024-07-11T14:20:36,246 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:20:36,246 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:20:36,246 | ^~~~~~~ 2024-07-11T14:20:36,676 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ufuncobject.h:4, 2024-07-11T14:20:36,676 from moleculekit/cython_utils/cython_utils.cpp:1269: 2024-07-11T14:20:36,677 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h: In function ‘npy_longdouble npy_creall(npy_clongdouble)’: 2024-07-11T14:20:36,677 /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/npy_math.h:405:13: warning: dereferencing type-punned pointer will break strict-aliasing rules [-Wstrict-aliasing] 2024-07-11T14:20:36,677 405 | return ((longdouble_t *) &z)[0]; 2024-07-11T14:20:36,677 | ~^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:21:01,675 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 2024-07-11T14:21:01,997 building 'moleculekit.xtc' extension 2024-07-11T14:21:01,998 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats 2024-07-11T14:21:01,998 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc 2024-07-11T14:21:01,999 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src 2024-07-11T14:21:02,000 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-k7hm872d/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 2024-07-11T14:21:02,239 moleculekit/fileformats/xtc/src/xdrfile.cpp:66:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,239 66 | "OK", 2024-07-11T14:21:02,239 | ^~~~ 2024-07-11T14:21:02,240 moleculekit/fileformats/xtc/src/xdrfile.cpp:67:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,240 67 | "Header", 2024-07-11T14:21:02,240 | ^~~~~~~~ 2024-07-11T14:21:02,240 moleculekit/fileformats/xtc/src/xdrfile.cpp:68:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,240 68 | "String", 2024-07-11T14:21:02,240 | ^~~~~~~~ 2024-07-11T14:21:02,240 moleculekit/fileformats/xtc/src/xdrfile.cpp:69:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,241 69 | "Double", 2024-07-11T14:21:02,241 | ^~~~~~~~ 2024-07-11T14:21:02,241 moleculekit/fileformats/xtc/src/xdrfile.cpp:70:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,241 70 | "Integer", 2024-07-11T14:21:02,241 | ^~~~~~~~~ 2024-07-11T14:21:02,241 moleculekit/fileformats/xtc/src/xdrfile.cpp:71:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,241 71 | "Float", 2024-07-11T14:21:02,241 | ^~~~~~~ 2024-07-11T14:21:02,242 moleculekit/fileformats/xtc/src/xdrfile.cpp:72:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,242 72 | "Unsigned integer", 2024-07-11T14:21:02,242 | ^~~~~~~~~~~~~~~~~~ 2024-07-11T14:21:02,242 moleculekit/fileformats/xtc/src/xdrfile.cpp:73:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,242 73 | "Compressed 3D coordinate", 2024-07-11T14:21:02,242 | ^~~~~~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:21:02,242 moleculekit/fileformats/xtc/src/xdrfile.cpp:74:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,243 74 | "Closing file", 2024-07-11T14:21:02,243 | ^~~~~~~~~~~~~~ 2024-07-11T14:21:02,243 moleculekit/fileformats/xtc/src/xdrfile.cpp:75:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,243 75 | "Magic number", 2024-07-11T14:21:02,243 | ^~~~~~~~~~~~~~ 2024-07-11T14:21:02,243 moleculekit/fileformats/xtc/src/xdrfile.cpp:76:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,243 76 | "Not enough memory", 2024-07-11T14:21:02,244 | ^~~~~~~~~~~~~~~~~~~ 2024-07-11T14:21:02,244 moleculekit/fileformats/xtc/src/xdrfile.cpp:77:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,244 77 | "End of file", 2024-07-11T14:21:02,244 | ^~~~~~~~~~~~~ 2024-07-11T14:21:02,244 moleculekit/fileformats/xtc/src/xdrfile.cpp:78:2: warning: ISO C++ forbids converting a string constant to ‘char*’ [-Wwrite-strings] 2024-07-11T14:21:02,244 78 | "File not found" 2024-07-11T14:21:02,244 | ^~~~~~~~~~~~~~~~ 2024-07-11T14:21:02,248 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofint(int)’: 2024-07-11T14:21:02,249 moleculekit/fileformats/xtc/src/xdrfile.cpp:459:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,249 459 | while (size >= num && num_of_bits < 32) 2024-07-11T14:21:02,249 | ~~~~~^~~~~~ 2024-07-11T14:21:02,249 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-07-11T14:21:02,249 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:02,249 505 | while (bytes[num_of_bytes] >= num) 2024-07-11T14:21:02,250 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-07-11T14:21:02,251 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-07-11T14:21:02,252 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,252 614 | if (num_of_bits >= num_of_bytes * 8) 2024-07-11T14:21:02,252 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-07-11T14:21:02,252 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,252 616 | for (i = 0; i < num_of_bytes; i++) 2024-07-11T14:21:02,252 | ~~^~~~~~~~~~~~~~ 2024-07-11T14:21:02,253 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,253 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-07-11T14:21:02,253 | ~~^~~~~~~~~~~~~~~~ 2024-07-11T14:21:02,253 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-07-11T14:21:02,253 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:16: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:02,253 664 | if (lastbits < num_of_bits) 2024-07-11T14:21:02,253 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-07-11T14:21:02,257 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-07-11T14:21:02,257 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:02,257 785 | if(size3>xfp->buf1size) 2024-07-11T14:21:02,257 | ~~~~~^~~~~~~~~~~~~~ 2024-07-11T14:21:02,259 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:02,259 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-07-11T14:21:02,262 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:02,262 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,262 935 | if(countmjh >= size3 ) { return -1; } 2024-07-11T14:21:02,262 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:02,262 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,262 938 | if(countmjh >= size3 ) { return -1; } 2024-07-11T14:21:02,262 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:02,263 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,263 945 | if(countmjh >= size3 ) { return -1; } 2024-07-11T14:21:02,263 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:02,263 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,263 948 | if(countmjh >= size3 ) { return -1; } 2024-07-11T14:21:02,263 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:02,263 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,264 951 | if(countmjh >= size3 ) { return -1; } 2024-07-11T14:21:02,264 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:02,264 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:17: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-07-11T14:21:02,264 756 | int smallidx, minidx, maxidx; 2024-07-11T14:21:02,264 | ^~~~~~ 2024-07-11T14:21:02,264 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:25: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-07-11T14:21:02,264 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-07-11T14:21:02,264 | ^~~~~~ 2024-07-11T14:21:02,264 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:6: warning: unused variable ‘errval’ [-Wunused-variable] 2024-07-11T14:21:02,265 763 | int errval=1; 2024-07-11T14:21:02,265 | ^~~~~~ 2024-07-11T14:21:02,265 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-07-11T14:21:02,266 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:02,266 1011 | if(size3>xfp->buf1size) 2024-07-11T14:21:02,266 | ~~~~~^~~~~~~~~~~~~~ 2024-07-11T14:21:02,268 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:29: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,268 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-07-11T14:21:02,268 | ~~~~~~~~^~~~~~~ 2024-07-11T14:21:02,268 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,269 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-07-11T14:21:02,269 | ~~~~~~~~^~~~~~~ 2024-07-11T14:21:02,269 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,269 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-07-11T14:21:02,269 | ~~~~~~~~^~~~~~~ 2024-07-11T14:21:02,271 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,271 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-07-11T14:21:02,271 | ^ 2024-07-11T14:21:02,271 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:02,271 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-07-11T14:21:02,279 | ~~~~~^~~~~~~~~~~~~~ 2024-07-11T14:21:02,280 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:02,280 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-07-11T14:21:02,286 | ~~~~~^~~~~~~~~~~~~~ 2024-07-11T14:21:02,289 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:02,290 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-07-11T14:21:02,290 | ^ 2024-07-11T14:21:02,290 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:02,290 1633 | maxidx = (LASTIDX= num && num_of_bits < 32) 2024-07-11T14:21:27,195 | ~~~~~^~~~~~ 2024-07-11T14:21:27,195 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int sizeofints(int, unsigned int*)’: 2024-07-11T14:21:27,196 moleculekit/fileformats/xtc/src/xdrfile.cpp:505:32: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:27,196 505 | while (bytes[num_of_bytes] >= num) 2024-07-11T14:21:27,196 | ~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-07-11T14:21:27,198 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘void encodeints(int*, int, int, unsigned int*, unsigned int*)’: 2024-07-11T14:21:27,198 moleculekit/fileformats/xtc/src/xdrfile.cpp:614:21: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,198 614 | if (num_of_bits >= num_of_bytes * 8) 2024-07-11T14:21:27,198 | ~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~ 2024-07-11T14:21:27,199 moleculekit/fileformats/xtc/src/xdrfile.cpp:616:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,199 616 | for (i = 0; i < num_of_bytes; i++) 2024-07-11T14:21:27,199 | ~~^~~~~~~~~~~~~~ 2024-07-11T14:21:27,199 moleculekit/fileformats/xtc/src/xdrfile.cpp:624:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,199 624 | for (i = 0; i < num_of_bytes-1; i++) 2024-07-11T14:21:27,199 | ~~^~~~~~~~~~~~~~~~ 2024-07-11T14:21:27,199 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int decodebits(int*, int)’: 2024-07-11T14:21:27,200 moleculekit/fileformats/xtc/src/xdrfile.cpp:664:16: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:27,200 664 | if (lastbits < num_of_bits) 2024-07-11T14:21:27,200 | ~~~~~~~~~^~~~~~~~~~~~~ 2024-07-11T14:21:27,203 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_decompress_coord_float(float*, int*, float*, XDRFILE*)’: 2024-07-11T14:21:27,203 moleculekit/fileformats/xtc/src/xdrfile.cpp:785:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:27,203 785 | if(size3>xfp->buf1size) 2024-07-11T14:21:27,204 | ~~~~~^~~~~~~~~~~~~~ 2024-07-11T14:21:27,205 moleculekit/fileformats/xtc/src/xdrfile.cpp:842:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:27,205 842 | maxidx = (LASTIDX= size3 ) { return -1; } 2024-07-11T14:21:27,208 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:27,208 moleculekit/fileformats/xtc/src/xdrfile.cpp:935:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,208 935 | if(countmjh >= size3 ) { return -1; } 2024-07-11T14:21:27,209 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:27,209 moleculekit/fileformats/xtc/src/xdrfile.cpp:938:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,209 938 | if(countmjh >= size3 ) { return -1; } 2024-07-11T14:21:27,209 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:27,209 moleculekit/fileformats/xtc/src/xdrfile.cpp:945:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,209 945 | if(countmjh >= size3 ) { return -1; } 2024-07-11T14:21:27,209 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:27,210 moleculekit/fileformats/xtc/src/xdrfile.cpp:948:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,210 948 | if(countmjh >= size3 ) { return -1; } 2024-07-11T14:21:27,210 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:27,210 moleculekit/fileformats/xtc/src/xdrfile.cpp:951:17: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,210 951 | if(countmjh >= size3 ) { return -1; } 2024-07-11T14:21:27,210 | ~~~~~~~~~^~~~~~~~ 2024-07-11T14:21:27,210 moleculekit/fileformats/xtc/src/xdrfile.cpp:756:17: warning: variable ‘minidx’ set but not used [-Wunused-but-set-variable] 2024-07-11T14:21:27,210 756 | int smallidx, minidx, maxidx; 2024-07-11T14:21:27,211 | ^~~~~~ 2024-07-11T14:21:27,211 moleculekit/fileformats/xtc/src/xdrfile.cpp:759:25: warning: variable ‘larger’ set but not used [-Wunused-but-set-variable] 2024-07-11T14:21:27,211 759 | int smallnum, smaller, larger, i, is_smaller, run; 2024-07-11T14:21:27,211 | ^~~~~~ 2024-07-11T14:21:27,211 moleculekit/fileformats/xtc/src/xdrfile.cpp:763:6: warning: unused variable ‘errval’ [-Wunused-variable] 2024-07-11T14:21:27,211 763 | int errval=1; 2024-07-11T14:21:27,211 | ^~~~~~ 2024-07-11T14:21:27,212 moleculekit/fileformats/xtc/src/xdrfile.cpp: In function ‘int xdrfile_compress_coord_float(float*, int, float, XDRFILE*)’: 2024-07-11T14:21:27,212 moleculekit/fileformats/xtc/src/xdrfile.cpp:1011:10: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:27,212 1011 | if(size3>xfp->buf1size) 2024-07-11T14:21:27,212 | ~~~~~^~~~~~~~~~~~~~ 2024-07-11T14:21:27,214 moleculekit/fileformats/xtc/src/xdrfile.cpp:1068:29: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,214 1068 | countmjh++; if( countmjh> size3) { return -1; } 2024-07-11T14:21:27,214 | ~~~~~~~~^~~~~~~ 2024-07-11T14:21:27,215 moleculekit/fileformats/xtc/src/xdrfile.cpp:1084:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,215 1084 | countmjh++; if( countmjh> size3) { return -1; } 2024-07-11T14:21:27,215 | ~~~~~~~~^~~~~~~ 2024-07-11T14:21:27,215 moleculekit/fileformats/xtc/src/xdrfile.cpp:1098:28: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,216 1098 | countmjh++; if( countmjh> size3) { return -1; } 2024-07-11T14:21:27,216 | ~~~~~~~~^~~~~~~ 2024-07-11T14:21:27,217 moleculekit/fileformats/xtc/src/xdrfile.cpp:1137:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,217 1137 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) 2024-07-11T14:21:27,217 | ^ 2024-07-11T14:21:27,218 moleculekit/fileformats/xtc/src/xdrfile.cpp:1143:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:27,218 1143 | maxidx = (LASTIDXxfp->buf1size) 2024-07-11T14:21:27,225 | ~~~~~^~~~~~~~~~~~~~ 2024-07-11T14:21:27,226 moleculekit/fileformats/xtc/src/xdrfile.cpp:1377:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:27,227 1377 | maxidx = (LASTIDXxfp->buf1size) { 2024-07-11T14:21:27,232 | ~~~~~^~~~~~~~~~~~~~ 2024-07-11T14:21:27,236 moleculekit/fileformats/xtc/src/xdrfile.cpp:1628:18: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:21:27,236 1628 | while (smallidx < LASTIDX && magicints[smallidx] < mindiff) { 2024-07-11T14:21:27,236 | ^ 2024-07-11T14:21:27,236 moleculekit/fileformats/xtc/src/xdrfile.cpp:1633:19: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:21:27,237 1633 | maxidx = (LASTIDX= __pyx_pybuffernd_forces.diminfo[2].shape)) __pyx_t_4 = 2; 2024-07-11T14:22:01,823 | ^ 2024-07-11T14:22:01,830 moleculekit/fileformats/xtc/trr.c:12009:19: warning: ‘__pyx_pybuffernd_forces.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,830 12009 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_forces.diminfo[1].shape)) __pyx_t_4 = 1; 2024-07-11T14:22:01,831 | ^ 2024-07-11T14:22:01,831 moleculekit/fileformats/xtc/trr.c:2485:95: warning: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,831 2485 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-07-11T14:22:01,832 | ^ 2024-07-11T14:22:01,837 moleculekit/fileformats/xtc/trr.c:10545:21: note: ‘__pyx_pybuffernd_forces.diminfo[0].strides’ was declared here 2024-07-11T14:22:01,838 10545 | __Pyx_LocalBuf_ND __pyx_pybuffernd_forces; 2024-07-11T14:22:01,838 | ^~~~~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:22:01,844 moleculekit/fileformats/xtc/trr.c:12003:59: warning: ‘__pyx_pybuffernd_forces.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,844 12003 | __pyx_t_28 += __pyx_pybuffernd_forces.diminfo[0].shape; 2024-07-11T14:22:01,844 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-07-11T14:22:01,851 moleculekit/fileformats/xtc/trr.c:11956:19: warning: ‘__pyx_pybuffernd_vel.diminfo[2].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,852 11956 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_vel.diminfo[2].shape)) __pyx_t_4 = 2; 2024-07-11T14:22:01,852 | ^ 2024-07-11T14:22:01,860 moleculekit/fileformats/xtc/trr.c:11952:19: warning: ‘__pyx_pybuffernd_vel.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,860 11952 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_vel.diminfo[1].shape)) __pyx_t_4 = 1; 2024-07-11T14:22:01,860 | ^ 2024-07-11T14:22:01,861 moleculekit/fileformats/xtc/trr.c:2485:95: warning: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,861 2485 | #define __Pyx_BufPtrCContig3d(type, buf, i0, s0, i1, s1, i2, s2) ((type)((char*)buf + i0 * s0 + i1 * s1) + i2) 2024-07-11T14:22:01,861 | ^ 2024-07-11T14:22:01,867 moleculekit/fileformats/xtc/trr.c:10561:21: note: ‘__pyx_pybuffernd_vel.diminfo[0].strides’ was declared here 2024-07-11T14:22:01,867 10561 | __Pyx_LocalBuf_ND __pyx_pybuffernd_vel; 2024-07-11T14:22:01,867 | ^~~~~~~~~~~~~~~~~~~~ 2024-07-11T14:22:01,873 moleculekit/fileformats/xtc/trr.c:11946:56: warning: ‘__pyx_pybuffernd_vel.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,873 11946 | __pyx_t_28 += __pyx_pybuffernd_vel.diminfo[0].shape; 2024-07-11T14:22:01,873 | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~ 2024-07-11T14:22:01,880 moleculekit/fileformats/xtc/trr.c:12345:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,880 12345 | } else if (unlikely(__pyx_t_29 >= __pyx_pybuffernd_xyz_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-07-11T14:22:01,880 | ^ 2024-07-11T14:22:01,887 moleculekit/fileformats/xtc/trr.c:12341:17: warning: ‘__pyx_pybuffernd_xyz_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,888 12341 | } else if (unlikely(__pyx_t_30 >= __pyx_pybuffernd_xyz_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-07-11T14:22:01,888 | ^ 2024-07-11T14:22:01,895 moleculekit/fileformats/xtc/trr.c:12186:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,896 12186 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_vel_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-07-11T14:22:01,896 | ^ 2024-07-11T14:22:01,903 moleculekit/fileformats/xtc/trr.c:12182:19: warning: ‘__pyx_pybuffernd_vel_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,904 12182 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_vel_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-07-11T14:22:01,904 | ^ 2024-07-11T14:22:01,910 moleculekit/fileformats/xtc/trr.c:12238:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[1].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,910 12238 | } else if (unlikely(__pyx_t_36 >= __pyx_pybuffernd_forces_buffer.diminfo[1].shape)) __pyx_t_4 = 1; 2024-07-11T14:22:01,910 | ^ 2024-07-11T14:22:01,917 moleculekit/fileformats/xtc/trr.c:12234:19: warning: ‘__pyx_pybuffernd_forces_buffer.diminfo[0].shape’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:01,918 12234 | } else if (unlikely(__pyx_t_35 >= __pyx_pybuffernd_forces_buffer.diminfo[0].shape)) __pyx_t_4 = 0; 2024-07-11T14:22:01,918 | ^ 2024-07-11T14:22:08,406 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 2024-07-11T14:22:08,593 building 'moleculekit.dcd' extension 2024-07-11T14:22:08,594 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd 2024-07-11T14:22:08,595 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src 2024-07-11T14:22:08,596 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-k7hm872d/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 2024-07-11T14:22:08,950 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:22:08,950 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:22:08,950 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:22:08,950 from moleculekit/fileformats/dcd/dcd.c:1256: 2024-07-11T14:22:08,951 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:22:08,951 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:22:08,951 | ^~~~~~~ 2024-07-11T14:22:09,974 In file included from moleculekit/fileformats/dcd/include/dcdplugin.h:1, 2024-07-11T14:22:09,974 from moleculekit/fileformats/dcd/dcd.c:1262: 2024-07-11T14:22:09,974 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-07-11T14:22:09,975 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-07-11T14:22:09,975 | ^~~~~~~~~~~~~ 2024-07-11T14:22:09,975 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-07-11T14:22:09,975 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-07-11T14:22:09,975 | ^~~~~~~~~~~~~~ 2024-07-11T14:22:09,975 moleculekit/fileformats/dcd/include/fastio.h:466:12: warning: ‘fio_write_int32’ defined but not used [-Wunused-function] 2024-07-11T14:22:09,975 466 | static int fio_write_int32(fio_fd fd, int i) { 2024-07-11T14:22:09,976 | ^~~~~~~~~~~~~~~ 2024-07-11T14:22:09,976 moleculekit/fileformats/dcd/include/fastio.h:457:19: warning: ‘fio_ftell’ defined but not used [-Wunused-function] 2024-07-11T14:22:09,976 457 | static fio_size_t fio_ftell(fio_fd fd) { 2024-07-11T14:22:09,976 | ^~~~~~~~~ 2024-07-11T14:22:09,976 moleculekit/fileformats/dcd/include/fastio.h:450:19: warning: ‘fio_fseek’ defined but not used [-Wunused-function] 2024-07-11T14:22:09,976 450 | static fio_size_t fio_fseek(fio_fd fd, fio_size_t offset, int whence) { 2024-07-11T14:22:09,976 | ^~~~~~~~~ 2024-07-11T14:22:09,977 moleculekit/fileformats/dcd/include/fastio.h:415:19: warning: ‘fio_readv’ defined but not used [-Wunused-function] 2024-07-11T14:22:09,977 415 | static fio_size_t fio_readv(fio_fd fd, const fio_iovec * iov, int iovcnt) { 2024-07-11T14:22:09,977 | ^~~~~~~~~ 2024-07-11T14:22:09,977 moleculekit/fileformats/dcd/include/fastio.h:394:12: warning: ‘fio_fclose’ defined but not used [-Wunused-function] 2024-07-11T14:22:09,977 394 | static int fio_fclose(fio_fd fd) { 2024-07-11T14:22:09,977 | ^~~~~~~~~~ 2024-07-11T14:22:09,977 moleculekit/fileformats/dcd/include/fastio.h:366:12: warning: ‘fio_open’ defined but not used [-Wunused-function] 2024-07-11T14:22:09,977 366 | static int fio_open(const char *filename, int mode, fio_fd *fd) { 2024-07-11T14:22:09,978 | ^~~~~~~~ 2024-07-11T14:22:22,649 moleculekit/fileformats/dcd/dcd.c: In function ‘__pyx_pf_11moleculekit_3dcd_17DCDTrajectoryFile_18read’: 2024-07-11T14:22:22,649 moleculekit/fileformats/dcd/dcd.c:1158:40: warning: ‘__pyx_v_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:22,649 1158 | #define PyInt_FromLong PyLong_FromLong 2024-07-11T14:22:22,649 | ^~~~~~~~~~~~~~~ 2024-07-11T14:22:22,654 moleculekit/fileformats/dcd/dcd.c:8476:7: note: ‘__pyx_v_i’ was declared here 2024-07-11T14:22:22,654 8476 | int __pyx_v_i; 2024-07-11T14:22:22,654 | ^~~~~~~~~ 2024-07-11T14:22:25,910 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-k7hm872d/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 2024-07-11T14:22:26,126 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdheader’: 2024-07-11T14:22:26,126 moleculekit/fileformats/dcd/src/dcdplugin.c:150:55: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:22:26,127 150 | else if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-07-11T14:22:26,127 | ^~ 2024-07-11T14:22:26,127 moleculekit/fileformats/dcd/src/dcdplugin.c:173:54: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:22:26,127 173 | if (input_integer[0] == 84 && input_integer[1] == dcdcordmagic) 2024-07-11T14:22:26,127 | ^~ 2024-07-11T14:22:26,127 moleculekit/fileformats/dcd/src/dcdplugin.c:194:26: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:22:26,128 194 | if (input_integer[0] != dcdcordmagic) 2024-07-11T14:22:26,128 | ^~ 2024-07-11T14:22:26,131 moleculekit/fileformats/dcd/src/dcdplugin.c:409:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:22:26,131 409 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-07-11T14:22:26,131 | ^~ 2024-07-11T14:22:26,131 moleculekit/fileformats/dcd/src/dcdplugin.c:428:47: warning: comparison of integer expressions of different signedness: ‘unsigned int’ and ‘int’ [-Wsign-compare] 2024-07-11T14:22:26,131 428 | if ((input_integer[0] + input_integer[1]) != ((*N) - (*NAMNF)) * 4) 2024-07-11T14:22:26,131 | ^~ 2024-07-11T14:22:26,135 moleculekit/fileformats/dcd/src/dcdplugin.c: In function ‘read_dcdstep’: 2024-07-11T14:22:26,135 moleculekit/fileformats/dcd/src/dcdplugin.c:651:23: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:22:26,135 651 | if (tmpbuf[i] != sizeof(float) * N) 2024-07-11T14:22:26,135 | ^~ 2024-07-11T14:22:26,136 moleculekit/fileformats/dcd/src/dcdplugin.c:659:49: warning: comparison of integer expressions of different signedness: ‘int’ and ‘unsigned int’ [-Wsign-compare] 2024-07-11T14:22:26,136 659 | if ((tmpbuf[2 * i] + tmpbuf[2 * i + 1]) != sizeof(float) * N) 2024-07-11T14:22:26,136 | ^~ 2024-07-11T14:22:26,158 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:55: 2024-07-11T14:22:26,159 At top level: 2024-07-11T14:22:26,159 moleculekit/fileformats/dcd/include/endianswap.h:96:13: warning: ‘swap2_aligned’ defined but not used [-Wunused-function] 2024-07-11T14:22:26,159 96 | static void swap2_aligned(void *v, long ndata) { 2024-07-11T14:22:26,159 | ^~~~~~~~~~~~~ 2024-07-11T14:22:26,159 moleculekit/fileformats/dcd/include/endianswap.h:32:13: warning: ‘swap2_unaligned’ defined but not used [-Wunused-function] 2024-07-11T14:22:26,159 32 | static void swap2_unaligned(void *v, long ndata) { 2024-07-11T14:22:26,160 | ^~~~~~~~~~~~~~~ 2024-07-11T14:22:26,160 In file included from moleculekit/fileformats/dcd/src/dcdplugin.c:46: 2024-07-11T14:22:26,160 moleculekit/fileformats/dcd/include/fastio.h:474:12: warning: ‘fio_write_str’ defined but not used [-Wunused-function] 2024-07-11T14:22:26,160 474 | static int fio_write_str(fio_fd fd, const char *str) { 2024-07-11T14:22:26,160 | ^~~~~~~~~~~~~ 2024-07-11T14:22:26,160 moleculekit/fileformats/dcd/include/fastio.h:470:12: warning: ‘fio_read_int32’ defined but not used [-Wunused-function] 2024-07-11T14:22:26,160 470 | static int fio_read_int32(fio_fd fd, int *i) { 2024-07-11T14:22:26,161 | ^~~~~~~~~~~~~~ 2024-07-11T14:22:27,260 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 2024-07-11T14:22:27,403 building 'moleculekit.binpos' extension 2024-07-11T14:22:27,404 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos 2024-07-11T14:22:27,405 creating build/temp.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src 2024-07-11T14:22:27,406 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-k7hm872d/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 2024-07-11T14:22:27,747 In file included from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarraytypes.h:1909, 2024-07-11T14:22:27,748 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/ndarrayobject.h:12, 2024-07-11T14:22:27,748 from /tmp/pip-build-env-k7hm872d/overlay/lib/python3.9/site-packages/numpy/_core/include/numpy/arrayobject.h:5, 2024-07-11T14:22:27,748 from moleculekit/fileformats/binpos/binpos.c:1256: 2024-07-11T14:22:27,748 /tmp/pip-build-env-k7hm872d/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] 2024-07-11T14:22:27,748 17 | #warning "Using deprecated NumPy API, disable it with " \ 2024-07-11T14:22:27,748 | ^~~~~~~ 2024-07-11T14:22:41,239 moleculekit/fileformats/binpos/binpos.c: In function ‘__pyx_pw_11moleculekit_6binpos_20BINPOSTrajectoryFile_7_read’: 2024-07-11T14:22:41,244 moleculekit/fileformats/binpos/binpos.c:8499:6: warning: ‘__pyx_v_status’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:41,244 8499 | if (__pyx_t_1) { 2024-07-11T14:22:41,244 | ^ 2024-07-11T14:22:41,248 moleculekit/fileformats/binpos/binpos.c:7976:7: note: ‘__pyx_v_status’ was declared here 2024-07-11T14:22:41,248 7976 | int __pyx_v_status; 2024-07-11T14:22:41,248 | ^~~~~~~~~~~~~~ 2024-07-11T14:22:41,249 moleculekit/fileformats/binpos/binpos.c:1158:40: warning: ‘__pyx_v_i’ may be used uninitialized in this function [-Wmaybe-uninitialized] 2024-07-11T14:22:41,249 1158 | #define PyInt_FromLong PyLong_FromLong 2024-07-11T14:22:41,249 | ^~~~~~~~~~~~~~~ 2024-07-11T14:22:41,253 moleculekit/fileformats/binpos/binpos.c:7973:7: note: ‘__pyx_v_i’ was declared here 2024-07-11T14:22:41,253 7973 | int __pyx_v_i; 2024-07-11T14:22:41,254 | ^~~~~~~~~ 2024-07-11T14:22:43,471 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-k7hm872d/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 2024-07-11T14:22:43,771 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 2024-07-11T14:22:43,910 building 'moleculekit.tmalign' extension 2024-07-11T14:22:43,911 creating build/temp.linux-armv7l-cpython-39/moleculekit/tmalign 2024-07-11T14:22:43,912 creating build/temp.linux-armv7l-cpython-39/moleculekit/tmalign/src 2024-07-11T14:22:43,913 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-k7hm872d/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 2024-07-11T14:23:13,406 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-k7hm872d/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 2024-07-11T14:23:31,869 In file included from /usr/include/c++/10/vector:72, 2024-07-11T14:23:31,870 from moleculekit/tmalign/tmalign_util.cpp:1280: 2024-07-11T14:23:31,870 /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]’: 2024-07-11T14:23:31,870 /usr/include/c++/10/bits/vector.tcc:426:7: note: parameter passing for argument of type ‘std::vector::iterator’ changed in GCC 7.1 2024-07-11T14:23:31,870 426 | vector<_Tp, _Alloc>:: 2024-07-11T14:23:31,870 | ^~~~~~~~~~~~~~~~~~~ 2024-07-11T14:23:32,451 In file included from /usr/include/c++/10/vector:67, 2024-07-11T14:23:32,451 from moleculekit/tmalign/tmalign_util.cpp:1280: 2024-07-11T14:23:32,451 /usr/include/c++/10/bits/stl_vector.h: In function ‘PyObject* __pyx_pw_11moleculekit_7tmalign_1tmalign(PyObject*, PyObject* const*, Py_ssize_t, PyObject*)’: 2024-07-11T14:23:32,451 /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 2024-07-11T14:23:32,452 1198 | _M_realloc_insert(end(), __x); 2024-07-11T14:23:32,452 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-07-11T14:23:32,452 /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 2024-07-11T14:23:32,452 1198 | _M_realloc_insert(end(), __x); 2024-07-11T14:23:32,452 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-07-11T14:23:32,453 /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 2024-07-11T14:23:32,453 1198 | _M_realloc_insert(end(), __x); 2024-07-11T14:23:32,453 | ~~~~~~~~~~~~~~~~~^~~~~~~~~~~~ 2024-07-11T14:23:34,890 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 2024-07-11T14:23:35,335 UPDATING build/lib.linux-armv7l-cpython-39/moleculekit/_version.py 2024-07-11T14:23:35,336 set build/lib.linux-armv7l-cpython-39/moleculekit/_version.py to '1.9.1' 2024-07-11T14:23:35,336 installing to build/bdist.linux-armv7l/wheel 2024-07-11T14:23:35,336 running install 2024-07-11T14:23:35,363 running install_lib 2024-07-11T14:23:35,370 creating build/bdist.linux-armv7l 2024-07-11T14:23:35,371 creating build/bdist.linux-armv7l/wheel 2024-07-11T14:23:35,374 creating build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,376 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmdgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,379 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,381 copying build/lib.linux-armv7l-cpython-39/moleculekit/rdkitintegration.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,384 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-07-11T14:23:35,385 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-07-11T14:23:35,387 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-07-11T14:23:35,388 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/src/binposplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/src 2024-07-11T14:23:35,391 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-07-11T14:23:35,395 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-07-11T14:23:35,396 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-07-11T14:23:35,400 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/binposplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-07-11T14:23:35,402 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos/include 2024-07-11T14:23:35,404 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binposlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-07-11T14:23:35,406 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/binpos/binpos.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/binpos 2024-07-11T14:23:35,426 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/netcdf.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-07-11T14:23:35,430 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-07-11T14:23:35,432 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-07-11T14:23:35,433 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcdlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-07-11T14:23:35,436 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-07-11T14:23:35,438 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/src/dcdplugin.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/src 2024-07-11T14:23:35,441 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-07-11T14:23:35,461 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-07-11T14:23:35,462 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/molfile_plugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-07-11T14:23:35,465 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/endianswap.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-07-11T14:23:35,468 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/fastio.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-07-11T14:23:35,471 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/largefiles.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-07-11T14:23:35,473 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/include/dcdplugin.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd/include 2024-07-11T14:23:35,476 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/dcd/dcd.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/dcd 2024-07-11T14:23:35,479 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/utils.py -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats 2024-07-11T14:23:35,482 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-07-11T14:23:35,483 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-07-11T14:23:35,504 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xdrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-07-11T14:23:35,506 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-07-11T14:23:35,527 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trrlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-07-11T14:23:35,529 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/trr.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-07-11T14:23:35,531 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtclib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-07-11T14:23:35,534 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-07-11T14:23:35,535 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-07-11T14:23:35,537 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-07-11T14:23:35,541 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdr_seek.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-07-11T14:23:35,543 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile_trr.c -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-07-11T14:23:35,545 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/src 2024-07-11T14:23:35,548 creating build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-07-11T14:23:35,549 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdr_seek.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-07-11T14:23:35,551 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-07-11T14:23:35,552 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/trr_header.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-07-11T14:23:35,554 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile_trr.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-07-11T14:23:35,556 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-07-11T14:23:35,558 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/include/xdrfile_xtc.h -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc/include 2024-07-11T14:23:35,560 copying build/lib.linux-armv7l-cpython-39/moleculekit/fileformats/xtc/xtc.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/fileformats/xtc 2024-07-11T14:23:35,562 creating build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-07-11T14:23:35,563 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-07-11T14:23:35,566 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping/wrapping.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/wrapping 2024-07-11T14:23:35,584 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,612 copying build/lib.linux-armv7l-cpython-39/moleculekit/xtc.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,634 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,635 copying build/lib.linux-armv7l-cpython-39/moleculekit/dcd.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,649 copying build/lib.linux-armv7l-cpython-39/moleculekit/home.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,651 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmd_wrapper -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,653 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-07-11T14:23:35,654 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-07-11T14:23:35,657 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils/atomselect_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect_utils 2024-07-11T14:23:35,686 copying build/lib.linux-armv7l-cpython-39/moleculekit/periodictable.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,689 copying build/lib.linux-armv7l-cpython-39/moleculekit/dihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,691 creating build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,692 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricshell.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,694 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/projection.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,696 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsecondarystructure.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,699 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsphericalcoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,701 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricfluctuation.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,703 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricrmsd.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,705 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricsasa.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,707 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricdistance.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,710 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricgyration.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,712 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,714 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metriccoordinate.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,716 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricdihedral.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,719 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metricplumed2.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,721 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/metrictmscore.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,723 copying build/lib.linux-armv7l-cpython-39/moleculekit/projections/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/projections 2024-07-11T14:23:35,726 creating build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-07-11T14:23:35,727 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-07-11T14:23:35,730 copying build/lib.linux-armv7l-cpython-39/moleculekit/distance_utils/distance_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/distance_utils 2024-07-11T14:23:35,753 copying build/lib.linux-armv7l-cpython-39/moleculekit/binpos.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:35,766 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-07-11T14:23:35,767 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/test_smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-07-11T14:23:35,769 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmolcdp.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-07-11T14:23:35,771 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-07-11T14:23:35,774 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/smallmol.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-07-11T14:23:35,777 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-07-11T14:23:35,779 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/test_smallmollib.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-07-11T14:23:35,781 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/util.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol 2024-07-11T14:23:35,784 creating build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-07-11T14:23:35,785 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/restrainedembed.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-07-11T14:23:35,787 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-07-11T14:23:35,789 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/clustering.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-07-11T14:23:35,791 copying build/lib.linux-armv7l-cpython-39/moleculekit/smallmol/tools/test_tools.py -> build/bdist.linux-armv7l/wheel/moleculekit/smallmol/tools 2024-07-11T14:23:35,794 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-07-11T14:23:35,795 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-07-11T14:23:35,796 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxReader.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-07-11T14:23:35,799 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-07-11T14:23:35,801 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxContainers.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-07-11T14:23:35,804 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/BinaryCifReader.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-07-11T14:23:35,806 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/reader/PdbxParser.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/reader 2024-07-11T14:23:35,809 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx 2024-07-11T14:23:35,811 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-07-11T14:23:35,812 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer/PdbxWriter.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-07-11T14:23:35,814 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/writer/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/writer 2024-07-11T14:23:35,816 creating build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-07-11T14:23:35,817 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxReaderTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-07-11T14:23:35,819 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxWriterTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-07-11T14:23:35,821 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/PdbxReadWriteTests.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-07-11T14:23:35,824 copying build/lib.linux-armv7l-cpython-39/moleculekit/pdbx/tests/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/pdbx/tests 2024-07-11T14:23:35,826 creating build/bdist.linux-armv7l/wheel/moleculekit/share 2024-07-11T14:23:35,827 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr 2024-07-11T14:23:35,831 creating build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,832 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/5JP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,834 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/APD.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,836 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,838 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DA2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,839 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/004.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,841 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,843 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/1MH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,845 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2ML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,847 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,849 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,851 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0A1.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,853 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NZC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,855 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2GX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,857 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LYZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,859 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,861 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DPP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,863 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IIL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,865 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,867 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,869 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,870 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/004.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,872 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AA4.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,874 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PRK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,876 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TYQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,878 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0BN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,879 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,881 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NAL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,883 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AHP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,885 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,887 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2MR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,889 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HHK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,891 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2MR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,893 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,895 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,897 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PCA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,898 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,900 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PCA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,901 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ONL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,903 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,905 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HHK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,907 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ME0.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,909 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,910 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,912 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ONL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,914 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/KYN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,916 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TPO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,918 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BB8.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,919 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,921 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TY2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,923 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,925 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,927 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GNC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,928 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLZ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,930 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,932 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,934 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TYQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,935 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LYZ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,937 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/P1L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,939 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DPP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,941 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,942 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ORM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,944 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0BN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,946 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HOX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,948 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AHP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,949 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,951 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IIL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,953 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/03Y.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,955 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/SEP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,957 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,958 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ESC.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,960 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DA2.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,962 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/KYN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,964 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/I2M.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,966 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,968 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/SEP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,970 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/APD.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,972 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAB.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,974 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ORM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,976 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,978 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MVA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,979 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OMX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,981 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0A1.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,983 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,985 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,987 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,989 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0AF.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,990 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LMQ.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,992 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,994 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LMQ.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,996 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ABA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:35,998 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2AS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,000 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HQA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,002 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2AS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,003 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/FGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,005 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,007 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HYP.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,009 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,011 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/D4P.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,013 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,015 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GHG.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,016 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,018 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GNC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,020 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ABA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,022 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,023 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,025 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,027 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GHG.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,029 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/FGL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,031 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BCS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,033 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BTK.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,035 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/M3L.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,037 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/03Y.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,039 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TY2.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,041 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YNM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,042 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,044 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MMO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,046 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/I2M.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,048 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,050 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YCM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,052 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/0AF.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,054 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NLE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,056 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/D4P.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,058 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PTR.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,060 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BB8.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,062 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MEA.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,064 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NLE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,066 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/MMO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,068 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4IN.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,070 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NVA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,072 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/GME.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,074 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CGU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,075 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLU.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,077 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4PH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,079 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/BTK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,081 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,083 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAB.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,085 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HPE.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,086 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HTR.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,088 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,090 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CSS.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,092 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ALY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,094 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IML.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,095 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,097 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NCY.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,099 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TPO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,101 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/PRK.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,103 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ESC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,105 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CGU.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,107 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/ME0.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,109 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NZC.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,111 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NCY.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,113 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HLX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,114 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/4IN.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,116 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/OMX.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,118 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/5JP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,120 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/DAH.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,122 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HYP.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,124 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HPE.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,126 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/CCS.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,127 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/LME.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,129 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TRO.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,131 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YNM.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,133 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/P1L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,135 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/NAL.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,137 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/M3L.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,140 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/TRO.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,141 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HQA.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,143 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/HOX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,145 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2GX.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,147 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/2ML.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,148 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/1MH.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,150 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/AA4.xml -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,152 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/.gitkeep -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,153 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/IGL.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,155 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/pdb2pqr/residues/YCM.dat -> build/bdist.linux-armv7l/wheel/moleculekit/share/pdb2pqr/residues 2024-07-11T14:23:36,157 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/backbone.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-07-11T14:23:36,159 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/ALA.cif -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-07-11T14:23:36,161 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/opm_sequences.json -> build/bdist.linux-armv7l/wheel/moleculekit/share 2024-07-11T14:23:36,360 creating build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-07-11T14:23:36,361 copying build/lib.linux-armv7l-cpython-39/moleculekit/share/atomselect/atomselect.json -> build/bdist.linux-armv7l/wheel/moleculekit/share/atomselect 2024-07-11T14:23:36,364 copying build/lib.linux-armv7l-cpython-39/moleculekit/opm.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,367 copying build/lib.linux-armv7l-cpython-39/moleculekit/_version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,369 copying build/lib.linux-armv7l-cpython-39/moleculekit/writers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,375 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-07-11T14:23:36,376 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalignlib.pxd -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-07-11T14:23:36,378 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-07-11T14:23:36,381 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/tmalign_util.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign 2024-07-11T14:23:36,421 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-07-11T14:23:36,422 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/src/TMAlign.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/src 2024-07-11T14:23:36,430 creating build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-07-11T14:23:36,431 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign/include/TMAlign.h -> build/bdist.linux-armv7l/wheel/moleculekit/tmalign/include 2024-07-11T14:23:36,433 copying build/lib.linux-armv7l-cpython-39/moleculekit/rcsb.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,435 copying build/lib.linux-armv7l-cpython-39/moleculekit/readers.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,440 copying build/lib.linux-armv7l-cpython-39/moleculekit/align.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,444 copying build/lib.linux-armv7l-cpython-39/moleculekit/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,446 copying build/lib.linux-armv7l-cpython-39/moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,500 copying build/lib.linux-armv7l-cpython-39/moleculekit/molecule.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,505 creating build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-07-11T14:23:36,505 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-07-11T14:23:36,507 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/yacc.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-07-11T14:23:36,511 copying build/lib.linux-armv7l-cpython-39/moleculekit/ply/lex.py -> build/bdist.linux-armv7l/wheel/moleculekit/ply 2024-07-11T14:23:36,513 copying build/lib.linux-armv7l-cpython-39/moleculekit/pymolgraphics.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,515 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,541 creating build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-07-11T14:23:36,542 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-07-11T14:23:36,545 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils/occupancy_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/occupancy_utils 2024-07-11T14:23:36,570 copying build/lib.linux-armv7l-cpython-39/moleculekit/logging.ini -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,572 copying build/lib.linux-armv7l-cpython-39/moleculekit/version.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,575 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-07-11T14:23:36,576 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-07-11T14:23:36,578 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-07-11T14:23:36,580 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi/cationpi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/cationpi 2024-07-11T14:23:36,601 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-07-11T14:23:36,624 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-07-11T14:23:36,625 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-07-11T14:23:36,645 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds/hbonds.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/hbonds 2024-07-11T14:23:36,648 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-07-11T14:23:36,649 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-07-11T14:23:36,670 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/pipi/pipi.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/pipi 2024-07-11T14:23:36,673 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/interactions.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-07-11T14:23:36,676 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-07-11T14:23:36,700 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-07-11T14:23:36,702 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-07-11T14:23:36,727 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit/interactions 2024-07-11T14:23:36,751 creating build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-07-11T14:23:36,752 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-07-11T14:23:36,755 copying build/lib.linux-armv7l-cpython-39/moleculekit/interactions/sigmahole/sigmahole.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/interactions/sigmahole 2024-07-11T14:23:36,777 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,797 copying build/lib.linux-armv7l-cpython-39/moleculekit/trr.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,822 creating build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-07-11T14:23:36,823 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-07-11T14:23:36,825 copying build/lib.linux-armv7l-cpython-39/moleculekit/cython_utils/cython_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/cython_utils 2024-07-11T14:23:36,844 copying build/lib.linux-armv7l-cpython-39/moleculekit/viewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,846 copying build/lib.linux-armv7l-cpython-39/moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,868 creating build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-07-11T14:23:36,870 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.cpp -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-07-11T14:23:36,889 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils/bondguesser_utils.pyx -> build/bdist.linux-armv7l/wheel/moleculekit/bondguesser_utils 2024-07-11T14:23:36,891 copying build/lib.linux-armv7l-cpython-39/moleculekit/vmdviewer.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,894 copying build/lib.linux-armv7l-cpython-39/moleculekit/util.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,897 copying build/lib.linux-armv7l-cpython-39/moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,919 copying build/lib.linux-armv7l-cpython-39/moleculekit/config.py -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,921 creating build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-07-11T14:23:36,922 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/atomselect.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-07-11T14:23:36,925 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/analyze.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-07-11T14:23:36,927 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/languageparser.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-07-11T14:23:36,929 copying build/lib.linux-armv7l-cpython-39/moleculekit/atomselect/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/atomselect 2024-07-11T14:23:36,931 copying build/lib.linux-armv7l-cpython-39/moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/moleculekit 2024-07-11T14:23:36,954 creating build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,955 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/autosegment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,958 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/atomtyper.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,960 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/docking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,963 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/moleculechecks.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,965 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/graphalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,967 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/preparation_customres.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,970 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/voxeldescriptors.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,973 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,974 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/modelling.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,977 creating build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-07-11T14:23:36,978 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools/__init__.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-07-11T14:23:36,980 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/obabel_tools/obabel_cli.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools/obabel_tools 2024-07-11T14:23:36,982 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/preparation.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,985 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/crystalpacking.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,987 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/sequencestructuralalignment.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,989 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/detect.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,992 copying build/lib.linux-armv7l-cpython-39/moleculekit/tools/hhblitsprofile.py -> build/bdist.linux-armv7l/wheel/moleculekit/tools 2024-07-11T14:23:36,994 running install_egg_info 2024-07-11T14:23:36,999 Copying moleculekit.egg-info to build/bdist.linux-armv7l/wheel/moleculekit-1.9.1-py3.9.egg-info 2024-07-11T14:23:37,013 running install_scripts 2024-07-11T14:23:37,060 creating build/bdist.linux-armv7l/wheel/moleculekit-1.9.1.dist-info/WHEEL 2024-07-11T14:23:37,063 creating '/tmp/pip-wheel-wxh707jd/.tmp-rxgh1lg2/moleculekit-1.9.1-cp39-cp39-linux_armv7l.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2024-07-11T14:23:37,066 adding 'moleculekit/__init__.py' 2024-07-11T14:23:37,068 adding 'moleculekit/_version.py' 2024-07-11T14:23:37,070 adding 'moleculekit/align.py' 2024-07-11T14:23:37,412 adding 'moleculekit/atomselect_utils.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:37,573 adding 'moleculekit/binpos.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:37,579 adding 'moleculekit/bondguesser.py' 2024-07-11T14:23:37,821 adding 'moleculekit/bondguesser_utils.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:37,830 adding 'moleculekit/config.py' 2024-07-11T14:23:38,086 adding 'moleculekit/cython_utils.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:38,257 adding 'moleculekit/dcd.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:38,263 adding 'moleculekit/dihedral.py' 2024-07-11T14:23:38,264 adding 'moleculekit/distance.py' 2024-07-11T14:23:38,592 adding 'moleculekit/distance_utils.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:38,604 adding 'moleculekit/home.py' 2024-07-11T14:23:38,605 adding 'moleculekit/logging.ini' 2024-07-11T14:23:38,619 adding 'moleculekit/molecule.py' 2024-07-11T14:23:38,845 adding 'moleculekit/occupancy_utils.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:38,854 adding 'moleculekit/opm.py' 2024-07-11T14:23:38,856 adding 'moleculekit/periodictable.py' 2024-07-11T14:23:38,858 adding 'moleculekit/pymolgraphics.py' 2024-07-11T14:23:38,859 adding 'moleculekit/rcsb.py' 2024-07-11T14:23:38,860 adding 'moleculekit/rdkitintegration.py' 2024-07-11T14:23:38,875 adding 'moleculekit/readers.py' 2024-07-11T14:23:39,476 adding 'moleculekit/tmalign.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:39,786 adding 'moleculekit/trr.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:39,798 adding 'moleculekit/util.py' 2024-07-11T14:23:39,800 adding 'moleculekit/version.py' 2024-07-11T14:23:39,801 adding 'moleculekit/viewer.py' 2024-07-11T14:23:39,803 adding 'moleculekit/vmd_wrapper' 2024-07-11T14:23:39,804 adding 'moleculekit/vmdgraphics.py' 2024-07-11T14:23:39,807 adding 'moleculekit/vmdviewer.py' 2024-07-11T14:23:40,058 adding 'moleculekit/wrapping.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:40,072 adding 'moleculekit/writers.py' 2024-07-11T14:23:40,339 adding 'moleculekit/xtc.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:40,349 adding 'moleculekit/atomselect/__init__.py' 2024-07-11T14:23:40,352 adding 'moleculekit/atomselect/analyze.py' 2024-07-11T14:23:40,354 adding 'moleculekit/atomselect/atomselect.py' 2024-07-11T14:23:40,356 adding 'moleculekit/atomselect/languageparser.py' 2024-07-11T14:23:40,461 adding 'moleculekit/atomselect_utils/atomselect_utils.cpp' 2024-07-11T14:23:40,472 adding 'moleculekit/atomselect_utils/atomselect_utils.pyx' 2024-07-11T14:23:40,565 adding 'moleculekit/bondguesser_utils/bondguesser_utils.cpp' 2024-07-11T14:23:40,574 adding 'moleculekit/bondguesser_utils/bondguesser_utils.pyx' 2024-07-11T14:23:40,665 adding 'moleculekit/cython_utils/cython_utils.cpp' 2024-07-11T14:23:40,673 adding 'moleculekit/cython_utils/cython_utils.pyx' 2024-07-11T14:23:40,778 adding 'moleculekit/distance_utils/distance_utils.cpp' 2024-07-11T14:23:40,789 adding 'moleculekit/distance_utils/distance_utils.pyx' 2024-07-11T14:23:40,790 adding 'moleculekit/fileformats/__init__.py' 2024-07-11T14:23:40,796 adding 'moleculekit/fileformats/netcdf.py' 2024-07-11T14:23:40,804 adding 'moleculekit/fileformats/utils.py' 2024-07-11T14:23:40,867 adding 'moleculekit/fileformats/binpos/binpos.c' 2024-07-11T14:23:40,874 adding 'moleculekit/fileformats/binpos/binpos.pyx' 2024-07-11T14:23:40,875 adding 'moleculekit/fileformats/binpos/binposlib.pxd' 2024-07-11T14:23:40,877 adding 'moleculekit/fileformats/binpos/include/binposplugin.h' 2024-07-11T14:23:40,879 adding 'moleculekit/fileformats/binpos/include/largefiles.h' 2024-07-11T14:23:40,884 adding 'moleculekit/fileformats/binpos/include/molfile_plugin.h' 2024-07-11T14:23:40,886 adding 'moleculekit/fileformats/binpos/src/binposplugin.c' 2024-07-11T14:23:40,950 adding 'moleculekit/fileformats/dcd/dcd.c' 2024-07-11T14:23:40,958 adding 'moleculekit/fileformats/dcd/dcd.pyx' 2024-07-11T14:23:40,960 adding 'moleculekit/fileformats/dcd/dcdlib.pxd' 2024-07-11T14:23:40,962 adding 'moleculekit/fileformats/dcd/include/dcdplugin.h' 2024-07-11T14:23:40,963 adding 'moleculekit/fileformats/dcd/include/endianswap.h' 2024-07-11T14:23:40,965 adding 'moleculekit/fileformats/dcd/include/fastio.h' 2024-07-11T14:23:40,966 adding 'moleculekit/fileformats/dcd/include/largefiles.h' 2024-07-11T14:23:40,971 adding 'moleculekit/fileformats/dcd/include/molfile_plugin.h' 2024-07-11T14:23:40,977 adding 'moleculekit/fileformats/dcd/src/dcdplugin.c' 2024-07-11T14:23:41,073 adding 'moleculekit/fileformats/xtc/trr.c' 2024-07-11T14:23:41,085 adding 'moleculekit/fileformats/xtc/trr.pyx' 2024-07-11T14:23:41,086 adding 'moleculekit/fileformats/xtc/trrlib.pxd' 2024-07-11T14:23:41,088 adding 'moleculekit/fileformats/xtc/xdrlib.pxd' 2024-07-11T14:23:41,178 adding 'moleculekit/fileformats/xtc/xtc.cpp' 2024-07-11T14:23:41,187 adding 'moleculekit/fileformats/xtc/xtc.pyx' 2024-07-11T14:23:41,188 adding 'moleculekit/fileformats/xtc/xtclib.pxd' 2024-07-11T14:23:41,190 adding 'moleculekit/fileformats/xtc/include/trr_header.h' 2024-07-11T14:23:41,191 adding 'moleculekit/fileformats/xtc/include/xdr_seek.h' 2024-07-11T14:23:41,194 adding 'moleculekit/fileformats/xtc/include/xdrfile.h' 2024-07-11T14:23:41,195 adding 'moleculekit/fileformats/xtc/include/xdrfile_trr.h' 2024-07-11T14:23:41,197 adding 'moleculekit/fileformats/xtc/include/xdrfile_xtc.h' 2024-07-11T14:23:41,198 adding 'moleculekit/fileformats/xtc/include/xtc.h' 2024-07-11T14:23:41,200 adding 'moleculekit/fileformats/xtc/src/xdr_seek.c' 2024-07-11T14:23:41,206 adding 'moleculekit/fileformats/xtc/src/xdrfile.cpp' 2024-07-11T14:23:41,209 adding 'moleculekit/fileformats/xtc/src/xdrfile_trr.c' 2024-07-11T14:23:41,210 adding 'moleculekit/fileformats/xtc/src/xdrfile_xtc.cpp' 2024-07-11T14:23:41,212 adding 'moleculekit/fileformats/xtc/src/xtc.cpp' 2024-07-11T14:23:41,214 adding 'moleculekit/interactions/__init__.py' 2024-07-11T14:23:41,498 adding 'moleculekit/interactions/cationpi.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:41,765 adding 'moleculekit/interactions/hbonds.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:41,777 adding 'moleculekit/interactions/interactions.py' 2024-07-11T14:23:42,059 adding 'moleculekit/interactions/pipi.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:42,347 adding 'moleculekit/interactions/sigmahole.cpython-39-arm-linux-gnueabihf.so' 2024-07-11T14:23:42,450 adding 'moleculekit/interactions/cationpi/cationpi.cpp' 2024-07-11T14:23:42,459 adding 'moleculekit/interactions/cationpi/cationpi.pyx' 2024-07-11T14:23:42,552 adding 'moleculekit/interactions/hbonds/hbonds.cpp' 2024-07-11T14:23:42,561 adding 'moleculekit/interactions/hbonds/hbonds.pyx' 2024-07-11T14:23:42,655 adding 'moleculekit/interactions/pipi/pipi.cpp' 2024-07-11T14:23:42,664 adding 'moleculekit/interactions/pipi/pipi.pyx' 2024-07-11T14:23:42,757 adding 'moleculekit/interactions/sigmahole/sigmahole.cpp' 2024-07-11T14:23:42,766 adding 'moleculekit/interactions/sigmahole/sigmahole.pyx' 2024-07-11T14:23:42,855 adding 'moleculekit/occupancy_utils/occupancy_utils.cpp' 2024-07-11T14:23:42,863 adding 'moleculekit/occupancy_utils/occupancy_utils.pyx' 2024-07-11T14:23:42,865 adding 'moleculekit/pdbx/__init__.py' 2024-07-11T14:23:42,868 adding 'moleculekit/pdbx/reader/BinaryCifReader.py' 2024-07-11T14:23:42,871 adding 'moleculekit/pdbx/reader/PdbxContainers.py' 2024-07-11T14:23:42,874 adding 'moleculekit/pdbx/reader/PdbxParser.py' 2024-07-11T14:23:42,877 adding 'moleculekit/pdbx/reader/PdbxReader.py' 2024-07-11T14:23:42,878 adding 'moleculekit/pdbx/reader/__init__.py' 2024-07-11T14:23:42,880 adding 'moleculekit/pdbx/tests/PdbxReadWriteTests.py' 2024-07-11T14:23:42,882 adding 'moleculekit/pdbx/tests/PdbxReaderTests.py' 2024-07-11T14:23:42,883 adding 'moleculekit/pdbx/tests/PdbxWriterTests.py' 2024-07-11T14:23:42,884 adding 'moleculekit/pdbx/tests/__init__.py' 2024-07-11T14:23:42,886 adding 'moleculekit/pdbx/writer/PdbxWriter.py' 2024-07-11T14:23:42,888 adding 'moleculekit/pdbx/writer/__init__.py' 2024-07-11T14:23:42,889 adding 'moleculekit/ply/__init__.py' 2024-07-11T14:23:42,894 adding 'moleculekit/ply/lex.py' 2024-07-11T14:23:42,905 adding 'moleculekit/ply/yacc.py' 2024-07-11T14:23:42,908 adding 'moleculekit/projections/__init__.py' 2024-07-11T14:23:42,910 adding 'moleculekit/projections/metriccoordinate.py' 2024-07-11T14:23:42,913 adding 'moleculekit/projections/metricdihedral.py' 2024-07-11T14:23:42,917 adding 'moleculekit/projections/metricdistance.py' 2024-07-11T14:23:42,919 adding 'moleculekit/projections/metricfluctuation.py' 2024-07-11T14:23:42,921 adding 'moleculekit/projections/metricgyration.py' 2024-07-11T14:23:42,925 adding 'moleculekit/projections/metricplumed2.py' 2024-07-11T14:23:42,927 adding 'moleculekit/projections/metricrmsd.py' 2024-07-11T14:23:42,929 adding 'moleculekit/projections/metricsasa.py' 2024-07-11T14:23:42,931 adding 'moleculekit/projections/metricsecondarystructure.py' 2024-07-11T14:23:42,933 adding 'moleculekit/projections/metricshell.py' 2024-07-11T14:23:42,935 adding 'moleculekit/projections/metricsphericalcoordinate.py' 2024-07-11T14:23:42,936 adding 'moleculekit/projections/metrictmscore.py' 2024-07-11T14:23:42,937 adding 'moleculekit/projections/projection.py' 2024-07-11T14:23:42,939 adding 'moleculekit/projections/util.py' 2024-07-11T14:23:42,941 adding 'moleculekit/share/ALA.cif' 2024-07-11T14:23:42,943 adding 'moleculekit/share/backbone.cif' 2024-07-11T14:23:44,250 adding 'moleculekit/share/opm_sequences.json' 2024-07-11T14:23:44,335 adding 'moleculekit/share/atomselect/atomselect.json' 2024-07-11T14:23:44,341 adding 'moleculekit/share/pdb2pqr/residues/.gitkeep' 2024-07-11T14:23:44,342 adding 'moleculekit/share/pdb2pqr/residues/004.dat' 2024-07-11T14:23:44,343 adding 'moleculekit/share/pdb2pqr/residues/004.xml' 2024-07-11T14:23:44,344 adding 'moleculekit/share/pdb2pqr/residues/03Y.dat' 2024-07-11T14:23:44,346 adding 'moleculekit/share/pdb2pqr/residues/03Y.xml' 2024-07-11T14:23:44,347 adding 'moleculekit/share/pdb2pqr/residues/0A1.dat' 2024-07-11T14:23:44,348 adding 'moleculekit/share/pdb2pqr/residues/0A1.xml' 2024-07-11T14:23:44,349 adding 'moleculekit/share/pdb2pqr/residues/0AF.dat' 2024-07-11T14:23:44,351 adding 'moleculekit/share/pdb2pqr/residues/0AF.xml' 2024-07-11T14:23:44,352 adding 'moleculekit/share/pdb2pqr/residues/0BN.dat' 2024-07-11T14:23:44,353 adding 'moleculekit/share/pdb2pqr/residues/0BN.xml' 2024-07-11T14:23:44,354 adding 'moleculekit/share/pdb2pqr/residues/1MH.dat' 2024-07-11T14:23:44,356 adding 'moleculekit/share/pdb2pqr/residues/1MH.xml' 2024-07-11T14:23:44,357 adding 'moleculekit/share/pdb2pqr/residues/2AS.dat' 2024-07-11T14:23:44,358 adding 'moleculekit/share/pdb2pqr/residues/2AS.xml' 2024-07-11T14:23:44,359 adding 'moleculekit/share/pdb2pqr/residues/2GX.dat' 2024-07-11T14:23:44,361 adding 'moleculekit/share/pdb2pqr/residues/2GX.xml' 2024-07-11T14:23:44,362 adding 'moleculekit/share/pdb2pqr/residues/2ML.dat' 2024-07-11T14:23:44,363 adding 'moleculekit/share/pdb2pqr/residues/2ML.xml' 2024-07-11T14:23:44,364 adding 'moleculekit/share/pdb2pqr/residues/2MR.dat' 2024-07-11T14:23:44,366 adding 'moleculekit/share/pdb2pqr/residues/2MR.xml' 2024-07-11T14:23:44,367 adding 'moleculekit/share/pdb2pqr/residues/4IN.dat' 2024-07-11T14:23:44,368 adding 'moleculekit/share/pdb2pqr/residues/4IN.xml' 2024-07-11T14:23:44,369 adding 'moleculekit/share/pdb2pqr/residues/4PH.dat' 2024-07-11T14:23:44,371 adding 'moleculekit/share/pdb2pqr/residues/4PH.xml' 2024-07-11T14:23:44,372 adding 'moleculekit/share/pdb2pqr/residues/4PQ.dat' 2024-07-11T14:23:44,373 adding 'moleculekit/share/pdb2pqr/residues/4PQ.xml' 2024-07-11T14:23:44,374 adding 'moleculekit/share/pdb2pqr/residues/5JP.dat' 2024-07-11T14:23:44,376 adding 'moleculekit/share/pdb2pqr/residues/5JP.xml' 2024-07-11T14:23:44,377 adding 'moleculekit/share/pdb2pqr/residues/AA4.dat' 2024-07-11T14:23:44,378 adding 'moleculekit/share/pdb2pqr/residues/AA4.xml' 2024-07-11T14:23:44,379 adding 'moleculekit/share/pdb2pqr/residues/ABA.dat' 2024-07-11T14:23:44,380 adding 'moleculekit/share/pdb2pqr/residues/ABA.xml' 2024-07-11T14:23:44,382 adding 'moleculekit/share/pdb2pqr/residues/AHP.dat' 2024-07-11T14:23:44,383 adding 'moleculekit/share/pdb2pqr/residues/AHP.xml' 2024-07-11T14:23:44,384 adding 'moleculekit/share/pdb2pqr/residues/ALC.dat' 2024-07-11T14:23:44,386 adding 'moleculekit/share/pdb2pqr/residues/ALC.xml' 2024-07-11T14:23:44,387 adding 'moleculekit/share/pdb2pqr/residues/ALN.dat' 2024-07-11T14:23:44,388 adding 'moleculekit/share/pdb2pqr/residues/ALN.xml' 2024-07-11T14:23:44,389 adding 'moleculekit/share/pdb2pqr/residues/ALY.dat' 2024-07-11T14:23:44,391 adding 'moleculekit/share/pdb2pqr/residues/ALY.xml' 2024-07-11T14:23:44,392 adding 'moleculekit/share/pdb2pqr/residues/APD.dat' 2024-07-11T14:23:44,393 adding 'moleculekit/share/pdb2pqr/residues/APD.xml' 2024-07-11T14:23:44,394 adding 'moleculekit/share/pdb2pqr/residues/BB8.dat' 2024-07-11T14:23:44,396 adding 'moleculekit/share/pdb2pqr/residues/BB8.xml' 2024-07-11T14:23:44,397 adding 'moleculekit/share/pdb2pqr/residues/BCS.dat' 2024-07-11T14:23:44,398 adding 'moleculekit/share/pdb2pqr/residues/BCS.xml' 2024-07-11T14:23:44,399 adding 'moleculekit/share/pdb2pqr/residues/BTK.dat' 2024-07-11T14:23:44,401 adding 'moleculekit/share/pdb2pqr/residues/BTK.xml' 2024-07-11T14:23:44,402 adding 'moleculekit/share/pdb2pqr/residues/CCS.dat' 2024-07-11T14:23:44,403 adding 'moleculekit/share/pdb2pqr/residues/CCS.xml' 2024-07-11T14:23:44,405 adding 'moleculekit/share/pdb2pqr/residues/CGU.dat' 2024-07-11T14:23:44,406 adding 'moleculekit/share/pdb2pqr/residues/CGU.xml' 2024-07-11T14:23:44,407 adding 'moleculekit/share/pdb2pqr/residues/CSA.dat' 2024-07-11T14:23:44,409 adding 'moleculekit/share/pdb2pqr/residues/CSA.xml' 2024-07-11T14:23:44,410 adding 'moleculekit/share/pdb2pqr/residues/CSO.dat' 2024-07-11T14:23:44,411 adding 'moleculekit/share/pdb2pqr/residues/CSO.xml' 2024-07-11T14:23:44,413 adding 'moleculekit/share/pdb2pqr/residues/CSP.dat' 2024-07-11T14:23:44,414 adding 'moleculekit/share/pdb2pqr/residues/CSP.xml' 2024-07-11T14:23:44,415 adding 'moleculekit/share/pdb2pqr/residues/CSS.dat' 2024-07-11T14:23:44,416 adding 'moleculekit/share/pdb2pqr/residues/CSS.xml' 2024-07-11T14:23:44,418 adding 'moleculekit/share/pdb2pqr/residues/D4P.dat' 2024-07-11T14:23:44,419 adding 'moleculekit/share/pdb2pqr/residues/D4P.xml' 2024-07-11T14:23:44,420 adding 'moleculekit/share/pdb2pqr/residues/DA2.dat' 2024-07-11T14:23:44,422 adding 'moleculekit/share/pdb2pqr/residues/DA2.xml' 2024-07-11T14:23:44,423 adding 'moleculekit/share/pdb2pqr/residues/DAB.dat' 2024-07-11T14:23:44,424 adding 'moleculekit/share/pdb2pqr/residues/DAB.xml' 2024-07-11T14:23:44,425 adding 'moleculekit/share/pdb2pqr/residues/DAH.dat' 2024-07-11T14:23:44,427 adding 'moleculekit/share/pdb2pqr/residues/DAH.xml' 2024-07-11T14:23:44,428 adding 'moleculekit/share/pdb2pqr/residues/DPP.dat' 2024-07-11T14:23:44,429 adding 'moleculekit/share/pdb2pqr/residues/DPP.xml' 2024-07-11T14:23:44,431 adding 'moleculekit/share/pdb2pqr/residues/ESC.dat' 2024-07-11T14:23:44,432 adding 'moleculekit/share/pdb2pqr/residues/ESC.xml' 2024-07-11T14:23:44,433 adding 'moleculekit/share/pdb2pqr/residues/FGL.dat' 2024-07-11T14:23:44,434 adding 'moleculekit/share/pdb2pqr/residues/FGL.xml' 2024-07-11T14:23:44,436 adding 'moleculekit/share/pdb2pqr/residues/GHG.dat' 2024-07-11T14:23:44,437 adding 'moleculekit/share/pdb2pqr/residues/GHG.xml' 2024-07-11T14:23:44,438 adding 'moleculekit/share/pdb2pqr/residues/GME.dat' 2024-07-11T14:23:44,439 adding 'moleculekit/share/pdb2pqr/residues/GME.xml' 2024-07-11T14:23:44,441 adding 'moleculekit/share/pdb2pqr/residues/GNC.dat' 2024-07-11T14:23:44,442 adding 'moleculekit/share/pdb2pqr/residues/GNC.xml' 2024-07-11T14:23:44,443 adding 'moleculekit/share/pdb2pqr/residues/HHK.dat' 2024-07-11T14:23:44,445 adding 'moleculekit/share/pdb2pqr/residues/HHK.xml' 2024-07-11T14:23:44,446 adding 'moleculekit/share/pdb2pqr/residues/HLU.dat' 2024-07-11T14:23:44,448 adding 'moleculekit/share/pdb2pqr/residues/HLU.xml' 2024-07-11T14:23:44,449 adding 'moleculekit/share/pdb2pqr/residues/HLX.dat' 2024-07-11T14:23:44,450 adding 'moleculekit/share/pdb2pqr/residues/HLX.xml' 2024-07-11T14:23:44,451 adding 'moleculekit/share/pdb2pqr/residues/HOX.dat' 2024-07-11T14:23:44,453 adding 'moleculekit/share/pdb2pqr/residues/HOX.xml' 2024-07-11T14:23:44,454 adding 'moleculekit/share/pdb2pqr/residues/HPE.dat' 2024-07-11T14:23:44,455 adding 'moleculekit/share/pdb2pqr/residues/HPE.xml' 2024-07-11T14:23:44,457 adding 'moleculekit/share/pdb2pqr/residues/HQA.dat' 2024-07-11T14:23:44,458 adding 'moleculekit/share/pdb2pqr/residues/HQA.xml' 2024-07-11T14:23:44,459 adding 'moleculekit/share/pdb2pqr/residues/HTR.dat' 2024-07-11T14:23:44,460 adding 'moleculekit/share/pdb2pqr/residues/HTR.xml' 2024-07-11T14:23:44,462 adding 'moleculekit/share/pdb2pqr/residues/HYP.dat' 2024-07-11T14:23:44,463 adding 'moleculekit/share/pdb2pqr/residues/HYP.xml' 2024-07-11T14:23:44,464 adding 'moleculekit/share/pdb2pqr/residues/I2M.dat' 2024-07-11T14:23:44,465 adding 'moleculekit/share/pdb2pqr/residues/I2M.xml' 2024-07-11T14:23:44,467 adding 'moleculekit/share/pdb2pqr/residues/IGL.dat' 2024-07-11T14:23:44,468 adding 'moleculekit/share/pdb2pqr/residues/IGL.xml' 2024-07-11T14:23:44,469 adding 'moleculekit/share/pdb2pqr/residues/IIL.dat' 2024-07-11T14:23:44,471 adding 'moleculekit/share/pdb2pqr/residues/IIL.xml' 2024-07-11T14:23:44,472 adding 'moleculekit/share/pdb2pqr/residues/IML.dat' 2024-07-11T14:23:44,473 adding 'moleculekit/share/pdb2pqr/residues/IML.xml' 2024-07-11T14:23:44,475 adding 'moleculekit/share/pdb2pqr/residues/KYN.dat' 2024-07-11T14:23:44,476 adding 'moleculekit/share/pdb2pqr/residues/KYN.xml' 2024-07-11T14:23:44,477 adding 'moleculekit/share/pdb2pqr/residues/LME.dat' 2024-07-11T14:23:44,479 adding 'moleculekit/share/pdb2pqr/residues/LME.xml' 2024-07-11T14:23:44,480 adding 'moleculekit/share/pdb2pqr/residues/LMQ.dat' 2024-07-11T14:23:44,481 adding 'moleculekit/share/pdb2pqr/residues/LMQ.xml' 2024-07-11T14:23:44,482 adding 'moleculekit/share/pdb2pqr/residues/LYZ.dat' 2024-07-11T14:23:44,484 adding 'moleculekit/share/pdb2pqr/residues/LYZ.xml' 2024-07-11T14:23:44,485 adding 'moleculekit/share/pdb2pqr/residues/M3L.dat' 2024-07-11T14:23:44,486 adding 'moleculekit/share/pdb2pqr/residues/M3L.xml' 2024-07-11T14:23:44,487 adding 'moleculekit/share/pdb2pqr/residues/ME0.dat' 2024-07-11T14:23:44,489 adding 'moleculekit/share/pdb2pqr/residues/ME0.xml' 2024-07-11T14:23:44,490 adding 'moleculekit/share/pdb2pqr/residues/MEA.dat' 2024-07-11T14:23:44,491 adding 'moleculekit/share/pdb2pqr/residues/MEA.xml' 2024-07-11T14:23:44,493 adding 'moleculekit/share/pdb2pqr/residues/MEN.dat' 2024-07-11T14:23:44,494 adding 'moleculekit/share/pdb2pqr/residues/MEN.xml' 2024-07-11T14:23:44,495 adding 'moleculekit/share/pdb2pqr/residues/MEQ.dat' 2024-07-11T14:23:44,496 adding 'moleculekit/share/pdb2pqr/residues/MEQ.xml' 2024-07-11T14:23:44,498 adding 'moleculekit/share/pdb2pqr/residues/MLE.dat' 2024-07-11T14:23:44,499 adding 'moleculekit/share/pdb2pqr/residues/MLE.xml' 2024-07-11T14:23:44,500 adding 'moleculekit/share/pdb2pqr/residues/MLY.dat' 2024-07-11T14:23:44,502 adding 'moleculekit/share/pdb2pqr/residues/MLY.xml' 2024-07-11T14:23:44,503 adding 'moleculekit/share/pdb2pqr/residues/MLZ.dat' 2024-07-11T14:23:44,504 adding 'moleculekit/share/pdb2pqr/residues/MLZ.xml' 2024-07-11T14:23:44,505 adding 'moleculekit/share/pdb2pqr/residues/MME.dat' 2024-07-11T14:23:44,507 adding 'moleculekit/share/pdb2pqr/residues/MME.xml' 2024-07-11T14:23:44,508 adding 'moleculekit/share/pdb2pqr/residues/MMO.dat' 2024-07-11T14:23:44,509 adding 'moleculekit/share/pdb2pqr/residues/MMO.xml' 2024-07-11T14:23:44,511 adding 'moleculekit/share/pdb2pqr/residues/MVA.dat' 2024-07-11T14:23:44,512 adding 'moleculekit/share/pdb2pqr/residues/MVA.xml' 2024-07-11T14:23:44,513 adding 'moleculekit/share/pdb2pqr/residues/NAL.dat' 2024-07-11T14:23:44,514 adding 'moleculekit/share/pdb2pqr/residues/NAL.xml' 2024-07-11T14:23:44,516 adding 'moleculekit/share/pdb2pqr/residues/NCY.dat' 2024-07-11T14:23:44,517 adding 'moleculekit/share/pdb2pqr/residues/NCY.xml' 2024-07-11T14:23:44,518 adding 'moleculekit/share/pdb2pqr/residues/NLE.dat' 2024-07-11T14:23:44,519 adding 'moleculekit/share/pdb2pqr/residues/NLE.xml' 2024-07-11T14:23:44,521 adding 'moleculekit/share/pdb2pqr/residues/NVA.dat' 2024-07-11T14:23:44,522 adding 'moleculekit/share/pdb2pqr/residues/NVA.xml' 2024-07-11T14:23:44,523 adding 'moleculekit/share/pdb2pqr/residues/NZC.dat' 2024-07-11T14:23:44,524 adding 'moleculekit/share/pdb2pqr/residues/NZC.xml' 2024-07-11T14:23:44,526 adding 'moleculekit/share/pdb2pqr/residues/OCY.dat' 2024-07-11T14:23:44,527 adding 'moleculekit/share/pdb2pqr/residues/OCY.xml' 2024-07-11T14:23:44,528 adding 'moleculekit/share/pdb2pqr/residues/OMX.dat' 2024-07-11T14:23:44,530 adding 'moleculekit/share/pdb2pqr/residues/OMX.xml' 2024-07-11T14:23:44,531 adding 'moleculekit/share/pdb2pqr/residues/ONL.dat' 2024-07-11T14:23:44,532 adding 'moleculekit/share/pdb2pqr/residues/ONL.xml' 2024-07-11T14:23:44,533 adding 'moleculekit/share/pdb2pqr/residues/ORM.dat' 2024-07-11T14:23:44,534 adding 'moleculekit/share/pdb2pqr/residues/ORM.xml' 2024-07-11T14:23:44,536 adding 'moleculekit/share/pdb2pqr/residues/P1L.dat' 2024-07-11T14:23:44,537 adding 'moleculekit/share/pdb2pqr/residues/P1L.xml' 2024-07-11T14:23:44,539 adding 'moleculekit/share/pdb2pqr/residues/PCA.dat' 2024-07-11T14:23:44,540 adding 'moleculekit/share/pdb2pqr/residues/PCA.xml' 2024-07-11T14:23:44,541 adding 'moleculekit/share/pdb2pqr/residues/PRK.dat' 2024-07-11T14:23:44,542 adding 'moleculekit/share/pdb2pqr/residues/PRK.xml' 2024-07-11T14:23:44,544 adding 'moleculekit/share/pdb2pqr/residues/PTR.dat' 2024-07-11T14:23:44,545 adding 'moleculekit/share/pdb2pqr/residues/PTR.xml' 2024-07-11T14:23:44,546 adding 'moleculekit/share/pdb2pqr/residues/SEP.dat' 2024-07-11T14:23:44,548 adding 'moleculekit/share/pdb2pqr/residues/SEP.xml' 2024-07-11T14:23:44,549 adding 'moleculekit/share/pdb2pqr/residues/TPO.dat' 2024-07-11T14:23:44,550 adding 'moleculekit/share/pdb2pqr/residues/TPO.xml' 2024-07-11T14:23:44,551 adding 'moleculekit/share/pdb2pqr/residues/TRO.dat' 2024-07-11T14:23:44,553 adding 'moleculekit/share/pdb2pqr/residues/TRO.xml' 2024-07-11T14:23:44,554 adding 'moleculekit/share/pdb2pqr/residues/TY2.dat' 2024-07-11T14:23:44,556 adding 'moleculekit/share/pdb2pqr/residues/TY2.xml' 2024-07-11T14:23:44,557 adding 'moleculekit/share/pdb2pqr/residues/TYQ.dat' 2024-07-11T14:23:44,558 adding 'moleculekit/share/pdb2pqr/residues/TYQ.xml' 2024-07-11T14:23:44,559 adding 'moleculekit/share/pdb2pqr/residues/YCM.dat' 2024-07-11T14:23:44,561 adding 'moleculekit/share/pdb2pqr/residues/YCM.xml' 2024-07-11T14:23:44,562 adding 'moleculekit/share/pdb2pqr/residues/YNM.dat' 2024-07-11T14:23:44,563 adding 'moleculekit/share/pdb2pqr/residues/YNM.xml' 2024-07-11T14:23:44,565 adding 'moleculekit/smallmol/__init__.py' 2024-07-11T14:23:44,570 adding 'moleculekit/smallmol/smallmol.py' 2024-07-11T14:23:44,572 adding 'moleculekit/smallmol/smallmolcdp.py' 2024-07-11T14:23:44,575 adding 'moleculekit/smallmol/smallmollib.py' 2024-07-11T14:23:44,577 adding 'moleculekit/smallmol/test_smallmol.py' 2024-07-11T14:23:44,578 adding 'moleculekit/smallmol/test_smallmollib.py' 2024-07-11T14:23:44,580 adding 'moleculekit/smallmol/util.py' 2024-07-11T14:23:44,582 adding 'moleculekit/smallmol/tools/__init__.py' 2024-07-11T14:23:44,584 adding 'moleculekit/smallmol/tools/clustering.py' 2024-07-11T14:23:44,585 adding 'moleculekit/smallmol/tools/restrainedembed.py' 2024-07-11T14:23:44,587 adding 'moleculekit/smallmol/tools/test_tools.py' 2024-07-11T14:23:44,678 adding 'moleculekit/tmalign/tmalign_util.cpp' 2024-07-11T14:23:44,687 adding 'moleculekit/tmalign/tmalign_util.pyx' 2024-07-11T14:23:44,688 adding 'moleculekit/tmalign/tmalignlib.pxd' 2024-07-11T14:23:44,690 adding 'moleculekit/tmalign/include/TMAlign.h' 2024-07-11T14:23:44,708 adding 'moleculekit/tmalign/src/TMAlign.cpp' 2024-07-11T14:23:44,711 adding 'moleculekit/tools/__init__.py' 2024-07-11T14:23:44,713 adding 'moleculekit/tools/atomtyper.py' 2024-07-11T14:23:44,716 adding 'moleculekit/tools/autosegment.py' 2024-07-11T14:23:44,718 adding 'moleculekit/tools/crystalpacking.py' 2024-07-11T14:23:44,721 adding 'moleculekit/tools/detect.py' 2024-07-11T14:23:44,723 adding 'moleculekit/tools/docking.py' 2024-07-11T14:23:44,725 adding 'moleculekit/tools/graphalignment.py' 2024-07-11T14:23:44,727 adding 'moleculekit/tools/hhblitsprofile.py' 2024-07-11T14:23:44,728 adding 'moleculekit/tools/modelling.py' 2024-07-11T14:23:44,730 adding 'moleculekit/tools/moleculechecks.py' 2024-07-11T14:23:44,736 adding 'moleculekit/tools/preparation.py' 2024-07-11T14:23:44,739 adding 'moleculekit/tools/preparation_customres.py' 2024-07-11T14:23:44,741 adding 'moleculekit/tools/sequencestructuralalignment.py' 2024-07-11T14:23:44,744 adding 'moleculekit/tools/voxeldescriptors.py' 2024-07-11T14:23:44,746 adding 'moleculekit/tools/obabel_tools/__init__.py' 2024-07-11T14:23:44,747 adding 'moleculekit/tools/obabel_tools/obabel_cli.py' 2024-07-11T14:23:44,840 adding 'moleculekit/wrapping/wrapping.cpp' 2024-07-11T14:23:44,850 adding 'moleculekit/wrapping/wrapping.pyx' 2024-07-11T14:23:44,852 adding 'moleculekit-1.9.1.dist-info/LICENSE' 2024-07-11T14:23:44,853 adding 'moleculekit-1.9.1.dist-info/METADATA' 2024-07-11T14:23:44,854 adding 'moleculekit-1.9.1.dist-info/WHEEL' 2024-07-11T14:23:44,855 adding 'moleculekit-1.9.1.dist-info/top_level.txt' 2024-07-11T14:23:44,861 adding 'moleculekit-1.9.1.dist-info/RECORD' 2024-07-11T14:23:45,036 removing build/bdist.linux-armv7l/wheel 2024-07-11T14:23:45,328 Building wheel for moleculekit (pyproject.toml): finished with status 'done' 2024-07-11T14:23:45,670 Created wheel for moleculekit: filename=moleculekit-1.9.1-cp39-cp39-linux_armv7l.whl size=14932985 sha256=7bfd68c4ee35c25aa2569cac08a2934d167dca7b1acd437b5ce788f78566e029 2024-07-11T14:23:45,671 Stored in directory: /tmp/pip-ephem-wheel-cache-ooyp6qe9/wheels/10/eb/1e/fdc35fda81fbd4143469e29318c20412cc957d4b59179ae4dd 2024-07-11T14:23:45,700 Successfully built moleculekit 2024-07-11T14:23:46,055 Removed build tracker: '/tmp/pip-build-tracker-atqtv3tc'