2023-10-16T09:06:45,224 Created temporary directory: /tmp/pip-build-tracker-v5lhwghk 2023-10-16T09:06:45,226 Initialized build tracking at /tmp/pip-build-tracker-v5lhwghk 2023-10-16T09:06:45,226 Created build tracker: /tmp/pip-build-tracker-v5lhwghk 2023-10-16T09:06:45,226 Entered build tracker: /tmp/pip-build-tracker-v5lhwghk 2023-10-16T09:06:45,227 Created temporary directory: /tmp/pip-wheel-9pdhgzqa 2023-10-16T09:06:45,230 Created temporary directory: /tmp/pip-ephem-wheel-cache-pc9vr29b 2023-10-16T09:06:45,253 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2023-10-16T09:06:45,257 2 location(s) to search for versions of adaptivepele: 2023-10-16T09:06:45,257 * https://pypi.org/simple/adaptivepele/ 2023-10-16T09:06:45,257 * https://www.piwheels.org/simple/adaptivepele/ 2023-10-16T09:06:45,258 Fetching project page and analyzing links: https://pypi.org/simple/adaptivepele/ 2023-10-16T09:06:45,259 Getting page https://pypi.org/simple/adaptivepele/ 2023-10-16T09:06:45,260 Found index url https://pypi.org/simple/ 2023-10-16T09:06:45,479 Fetched page https://pypi.org/simple/adaptivepele/ as application/vnd.pypi.simple.v1+json 2023-10-16T09:06:45,481 Found link https://files.pythonhosted.org/packages/33/ee/476a691d254663e61362e5c2754180ff0b92980e6db1afc829265f001706/AdaptivePELE-1.5.1.tar.gz (from https://pypi.org/simple/adaptivepele/), version: 1.5.1 2023-10-16T09:06:45,482 Found link https://files.pythonhosted.org/packages/d9/82/be65cbae39642401f6e6923e5511fd466d107920ee9673bb84581a243a4e/AdaptivePELE-1.5.2.tar.gz (from https://pypi.org/simple/adaptivepele/), version: 1.5.2 2023-10-16T09:06:45,483 Found link https://files.pythonhosted.org/packages/48/3b/f12bfdcfd7f0fdcb2f58d659ff94c26666767eec4ca8454750a3241c395e/AdaptivePELE-1.6.tar.gz (from https://pypi.org/simple/adaptivepele/), version: 1.6 2023-10-16T09:06:45,483 Found link https://files.pythonhosted.org/packages/d0/1b/f731952d133f4a684ae4376f67513af80d1f759b9ef4d6137767e0fc8ed9/AdaptivePELE-1.6.2.tar.gz (from https://pypi.org/simple/adaptivepele/), version: 1.6.2 2023-10-16T09:06:45,484 Found link https://files.pythonhosted.org/packages/25/2c/65b787dc210294855b8f27abeb4a7761f25fce34e0b8bfd56779c679440d/AdaptivePELE-1.6.3.tar.gz (from https://pypi.org/simple/adaptivepele/), version: 1.6.3 2023-10-16T09:06:45,485 Found link https://files.pythonhosted.org/packages/2b/34/d4545814438fa2992d83f5be0389f6465ab3e542ada0c02f90dbc4cc5695/AdaptivePELE-1.7.tar.gz (from https://pypi.org/simple/adaptivepele/), version: 1.7 2023-10-16T09:06:45,486 Found link https://files.pythonhosted.org/packages/21/7d/8c8eb27cbe21dfcfbf80d5f16c889ee2d5bf0eec8dd8bcd03567d06bef98/AdaptivePELE-1.7.1.tar.gz (from https://pypi.org/simple/adaptivepele/), version: 1.7.1 2023-10-16T09:06:45,486 Found link https://files.pythonhosted.org/packages/d2/2a/993f92a15fee18f51f48793e865e2626d51c441ba7ec4565480fad4391d6/AdaptivePELE-1.7.4.tar.gz (from https://pypi.org/simple/adaptivepele/), version: 1.7.4 2023-10-16T09:06:45,487 Fetching project page and analyzing links: https://www.piwheels.org/simple/adaptivepele/ 2023-10-16T09:06:45,488 Getting page https://www.piwheels.org/simple/adaptivepele/ 2023-10-16T09:06:45,489 Found index url https://www.piwheels.org/simple/ 2023-10-16T09:06:45,655 Fetched page https://www.piwheels.org/simple/adaptivepele/ as text/html 2023-10-16T09:06:45,664 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.7.1-cp39-cp39-linux_armv7l.whl#sha256=8ba47dab67ab6fbd1e1bd022bdee1d4de408ec335fecc88108e7a3d295f378e9 (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,665 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.7.1-cp39-cp39-linux_armv6l.whl#sha256=8ba47dab67ab6fbd1e1bd022bdee1d4de408ec335fecc88108e7a3d295f378e9 (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,665 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.7.1-cp37-cp37m-linux_armv7l.whl#sha256=3292b60b31353aeff2e1832f504c186c202729cba0948d5ed44a194fab7eb63d (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,666 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.7.1-cp37-cp37m-linux_armv6l.whl#sha256=3292b60b31353aeff2e1832f504c186c202729cba0948d5ed44a194fab7eb63d (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,667 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.7.1-cp35-cp35m-linux_armv7l.whl#sha256=0208e16fec704fe2c144f233c3bcad9bd699844776c4d69a84cbeea650e527cf (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,667 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.7.1-cp35-cp35m-linux_armv6l.whl#sha256=0208e16fec704fe2c144f233c3bcad9bd699844776c4d69a84cbeea650e527cf (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,668 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.7-cp37-cp37m-linux_armv7l.whl#sha256=9ceafd1bdad9148abd951ec26b53c062af8565c6ed7df8a4833b0a5b1af150b6 (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,668 Skipping link: No binaries permitted for adaptivepele: 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https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.6.3-cp37-cp37m-linux_armv7l.whl#sha256=fc72f5016a0826fbe3b3a251f574c128cfffc1e1080f6ef21d32ae9134214087 (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,670 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.6.3-cp37-cp37m-linux_armv6l.whl#sha256=fc72f5016a0826fbe3b3a251f574c128cfffc1e1080f6ef21d32ae9134214087 (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,671 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.6.3-cp35-cp35m-linux_armv7l.whl#sha256=843a4ba6b03c34f08d3926f9c672ffecbe27f2d3a031f4e04cfba5ab92bf081b (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,671 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.6.3-cp35-cp35m-linux_armv6l.whl#sha256=843a4ba6b03c34f08d3926f9c672ffecbe27f2d3a031f4e04cfba5ab92bf081b (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,672 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.6.2-cp34-cp34m-linux_armv6l.whl#sha256=4f4aaf9237f2698965935feac86131663c03ebcf1f93aec451b35f8ce80d4c09 (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,672 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.6.2-cp34-cp34m-linux_armv7l.whl#sha256=4f4aaf9237f2698965935feac86131663c03ebcf1f93aec451b35f8ce80d4c09 (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,673 Skipping link: No binaries permitted for adaptivepele: 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https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.5.1-cp35-cp35m-linux_armv6l.whl#sha256=11454cd28dbb1fac72eedb48155487d4e6a36fe5bf4ba70d1df2f81984690f5f (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,680 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.5.1-cp35-cp35m-linux_armv7l.whl#sha256=11454cd28dbb1fac72eedb48155487d4e6a36fe5bf4ba70d1df2f81984690f5f (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,681 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.5.1-cp34-cp34m-linux_armv7l.whl#sha256=ae482fbe798dddf382cbba7468496c022b12752804d218c198b78c1183e5342a (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,682 Skipping link: No binaries permitted for adaptivepele: https://www.piwheels.org/simple/adaptivepele/AdaptivePELE-1.5.1-cp34-cp34m-linux_armv6l.whl#sha256=ae482fbe798dddf382cbba7468496c022b12752804d218c198b78c1183e5342a (from https://www.piwheels.org/simple/adaptivepele/) 2023-10-16T09:06:45,682 Skipping link: not a file: https://www.piwheels.org/simple/adaptivepele/ 2023-10-16T09:06:45,683 Skipping link: not a file: https://pypi.org/simple/adaptivepele/ 2023-10-16T09:06:45,702 Given no hashes to check 1 links for project 'adaptivepele': discarding no candidates 2023-10-16T09:06:45,720 Collecting adaptivepele==1.7.4 2023-10-16T09:06:45,722 Created temporary directory: /tmp/pip-unpack-vsv93ouq 2023-10-16T09:06:45,938 Downloading AdaptivePELE-1.7.4.tar.gz (219 kB) 2023-10-16T09:06:46,286 Added adaptivepele==1.7.4 from https://files.pythonhosted.org/packages/d2/2a/993f92a15fee18f51f48793e865e2626d51c441ba7ec4565480fad4391d6/AdaptivePELE-1.7.4.tar.gz to build tracker '/tmp/pip-build-tracker-v5lhwghk' 2023-10-16T09:06:46,288 Running setup.py (path:/tmp/pip-wheel-9pdhgzqa/adaptivepele_1b2729e943984970bad4b01533c692a0/setup.py) egg_info for package adaptivepele 2023-10-16T09:06:46,289 Created temporary directory: /tmp/pip-pip-egg-info-65vf_we_ 2023-10-16T09:06:46,289 Preparing metadata (setup.py): started 2023-10-16T09:06:46,290 Running command python setup.py egg_info 2023-10-16T09:06:47,263 Warning: 'classifiers' should be a list, got type 'tuple' 2023-10-16T09:06:47,638 running egg_info 2023-10-16T09:06:47,640 creating /tmp/pip-pip-egg-info-65vf_we_/AdaptivePELE.egg-info 2023-10-16T09:06:47,666 writing /tmp/pip-pip-egg-info-65vf_we_/AdaptivePELE.egg-info/PKG-INFO 2023-10-16T09:06:47,670 writing dependency_links to /tmp/pip-pip-egg-info-65vf_we_/AdaptivePELE.egg-info/dependency_links.txt 2023-10-16T09:06:47,672 writing requirements to /tmp/pip-pip-egg-info-65vf_we_/AdaptivePELE.egg-info/requires.txt 2023-10-16T09:06:47,673 writing top-level names to /tmp/pip-pip-egg-info-65vf_we_/AdaptivePELE.egg-info/top_level.txt 2023-10-16T09:06:47,674 writing manifest file '/tmp/pip-pip-egg-info-65vf_we_/AdaptivePELE.egg-info/SOURCES.txt' 2023-10-16T09:06:47,763 reading manifest file '/tmp/pip-pip-egg-info-65vf_we_/AdaptivePELE.egg-info/SOURCES.txt' 2023-10-16T09:06:47,764 reading manifest template 'MANIFEST.in' 2023-10-16T09:06:47,776 warning: no files found matching 'utils.c' under directory 'AdaptivePELE/freeEnergies' 2023-10-16T09:06:47,783 warning: no files found matching 'utils*.so' under directory 'AdaptivePELE/freeEnergies' 2023-10-16T09:06:47,784 adding license file 'LICENSE' 2023-10-16T09:06:47,789 writing manifest file '/tmp/pip-pip-egg-info-65vf_we_/AdaptivePELE.egg-info/SOURCES.txt' 2023-10-16T09:06:47,932 Preparing metadata (setup.py): finished with status 'done' 2023-10-16T09:06:47,936 Source in /tmp/pip-wheel-9pdhgzqa/adaptivepele_1b2729e943984970bad4b01533c692a0 has version 1.7.4, which satisfies requirement adaptivepele==1.7.4 from https://files.pythonhosted.org/packages/d2/2a/993f92a15fee18f51f48793e865e2626d51c441ba7ec4565480fad4391d6/AdaptivePELE-1.7.4.tar.gz 2023-10-16T09:06:47,937 Removed adaptivepele==1.7.4 from https://files.pythonhosted.org/packages/d2/2a/993f92a15fee18f51f48793e865e2626d51c441ba7ec4565480fad4391d6/AdaptivePELE-1.7.4.tar.gz from build tracker '/tmp/pip-build-tracker-v5lhwghk' 2023-10-16T09:06:47,942 Created temporary directory: /tmp/pip-unpack-wne7qpjh 2023-10-16T09:06:47,943 Created temporary directory: /tmp/pip-unpack-c70q7p9o 2023-10-16T09:06:47,950 Building wheels for collected packages: adaptivepele 2023-10-16T09:06:47,955 Created temporary directory: /tmp/pip-wheel-6mi225i2 2023-10-16T09:06:47,955 Building wheel for adaptivepele (setup.py): started 2023-10-16T09:06:47,957 Destination directory: /tmp/pip-wheel-6mi225i2 2023-10-16T09:06:47,958 Running command python setup.py bdist_wheel 2023-10-16T09:06:48,815 Warning: 'classifiers' should be a list, got type 'tuple' 2023-10-16T09:06:49,185 running bdist_wheel 2023-10-16T09:06:49,258 running build 2023-10-16T09:06:49,259 running build_py 2023-10-16T09:06:49,286 creating build 2023-10-16T09:06:49,287 creating build/lib.linux-armv7l-cpython-311 2023-10-16T09:06:49,288 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE 2023-10-16T09:06:49,289 copying AdaptivePELE/adaptiveSampling.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE 2023-10-16T09:06:49,292 copying AdaptivePELE/makeRelease.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE 2023-10-16T09:06:49,294 copying AdaptivePELE/runAllTests.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE 2023-10-16T09:06:49,296 copying AdaptivePELE/automateRoundsAdaptive.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE 2023-10-16T09:06:49,298 copying AdaptivePELE/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE 2023-10-16T09:06:49,300 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,301 copying AdaptivePELE/tests/testReporter.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,303 copying AdaptivePELE/tests/testClustering.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,306 copying AdaptivePELE/tests/testMD.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,308 copying AdaptivePELE/tests/testSpawning.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,310 copying AdaptivePELE/tests/testDensityCalculator.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,312 copying AdaptivePELE/tests/testMD_CUDA.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,314 copying AdaptivePELE/tests/testAdaptiveSampling.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,316 copying AdaptivePELE/tests/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,318 copying AdaptivePELE/tests/testAtomset.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,320 copying AdaptivePELE/tests/testSimulationRunner.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,322 copying AdaptivePELE/tests/testThresholdcalculator.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests 2023-10-16T09:06:49,325 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,326 copying AdaptivePELE/analysis/networkCM.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,328 copying AdaptivePELE/analysis/pathwayRMSD.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,330 copying AdaptivePELE/analysis/addRejectedSteps.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,332 copying AdaptivePELE/analysis/writeClusteringStructures.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,334 copying AdaptivePELE/analysis/dehidratate_and_align.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,335 copying AdaptivePELE/analysis/clusterAdaptiveRun.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,338 copying AdaptivePELE/analysis/unbinding.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,339 copying AdaptivePELE/analysis/convertTrajectory.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,341 copying AdaptivePELE/analysis/interactivePlot.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,344 copying AdaptivePELE/analysis/cluster.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,346 copying AdaptivePELE/analysis/filter_by_radius.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,348 copying AdaptivePELE/analysis/analysis_utils.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,350 copying AdaptivePELE/analysis/makeRMSDClustering.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,352 copying AdaptivePELE/analysis/selectOnPlot.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,354 copying AdaptivePELE/analysis/plotSpawningClusters.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,356 copying AdaptivePELE/analysis/standarize_MD_energies.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,358 copying AdaptivePELE/analysis/autoCorrelation.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,360 copying AdaptivePELE/analysis/makePNGs.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,362 copying AdaptivePELE/analysis/generateBox.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,364 copying AdaptivePELE/analysis/findfirstbindingevent.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,366 copying AdaptivePELE/analysis/plotRMSF.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,368 copying AdaptivePELE/analysis/identifyClusterSnapshot.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,370 copying AdaptivePELE/analysis/analyse.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,372 copying AdaptivePELE/analysis/clusters_lagtime_grid.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,374 copying AdaptivePELE/analysis/writeNetworkFiles.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,376 copying AdaptivePELE/analysis/plotAdaptive.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,378 copying AdaptivePELE/analysis/simple_postprocessing.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,380 copying AdaptivePELE/analysis/histCM.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,382 copying AdaptivePELE/analysis/plot3DNetwork.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,384 copying AdaptivePELE/analysis/numberOfClusters.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,386 copying AdaptivePELE/analysis/extract_ligand_traj.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,388 copying AdaptivePELE/analysis/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,389 copying AdaptivePELE/analysis/bestStructs.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,392 copying AdaptivePELE/analysis/splitTrajectory.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,394 copying AdaptivePELE/analysis/writeTrajToSnapshot.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,395 copying AdaptivePELE/analysis/crossValidationClustering.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,397 copying AdaptivePELE/analysis/count_clusters.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,399 copying AdaptivePELE/analysis/correctRMSD.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,402 copying AdaptivePELE/analysis/compareClustering.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,404 copying AdaptivePELE/analysis/calculateSASAvalues.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,406 copying AdaptivePELE/analysis/reportSimulation.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,408 copying AdaptivePELE/analysis/simulationToCsv.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,410 copying AdaptivePELE/analysis/analyseClustering.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,412 copying AdaptivePELE/analysis/foldersFirstBindingEvent.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,413 copying AdaptivePELE/analysis/trajectory_processing.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,415 copying AdaptivePELE/analysis/backtrackAdaptiveTrajectory.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,418 copying AdaptivePELE/analysis/calculateDistances.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis 2023-10-16T09:06:49,420 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering 2023-10-16T09:06:49,421 copying AdaptivePELE/clustering/thresholdcalculatortypes.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering 2023-10-16T09:06:49,423 copying AdaptivePELE/clustering/thresholdcalculator.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering 2023-10-16T09:06:49,425 copying AdaptivePELE/clustering/clustering.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering 2023-10-16T09:06:49,428 copying AdaptivePELE/clustering/clusteringTypes.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering 2023-10-16T09:06:49,430 copying AdaptivePELE/clustering/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering 2023-10-16T09:06:49,432 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning 2023-10-16T09:06:49,433 copying AdaptivePELE/spawning/densitycalculator.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning 2023-10-16T09:06:49,435 copying AdaptivePELE/spawning/spawning.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning 2023-10-16T09:06:49,439 copying AdaptivePELE/spawning/spawningTypes.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning 2023-10-16T09:06:49,441 copying AdaptivePELE/spawning/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning 2023-10-16T09:06:49,442 copying AdaptivePELE/spawning/densitycalculatortypes.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning 2023-10-16T09:06:49,444 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE/validator 2023-10-16T09:06:49,445 copying AdaptivePELE/validator/controlFileValidator.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/validator 2023-10-16T09:06:49,447 copying AdaptivePELE/validator/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/validator 2023-10-16T09:06:49,449 copying AdaptivePELE/validator/validatorBlockNames.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/validator 2023-10-16T09:06:49,452 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities 2023-10-16T09:06:49,453 copying AdaptivePELE/utilities/generate_topology_object.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities 2023-10-16T09:06:49,454 copying AdaptivePELE/utilities/utilities.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities 2023-10-16T09:06:49,457 copying AdaptivePELE/utilities/clusteringUtilities.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities 2023-10-16T09:06:49,459 copying AdaptivePELE/utilities/PDBLoader.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities 2023-10-16T09:06:49,462 copying AdaptivePELE/utilities/conda_deployment.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities 2023-10-16T09:06:49,463 copying AdaptivePELE/utilities/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities 2023-10-16T09:06:49,465 copying AdaptivePELE/utilities/synchronization.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities 2023-10-16T09:06:49,468 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset 2023-10-16T09:06:49,469 copying AdaptivePELE/atomset/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset 2023-10-16T09:06:49,470 copying AdaptivePELE/atomset/setup.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset 2023-10-16T09:06:49,472 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE/simulation 2023-10-16T09:06:49,473 copying AdaptivePELE/simulation/openmm_simulations.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/simulation 2023-10-16T09:06:49,476 copying AdaptivePELE/simulation/simulationrunner.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/simulation 2023-10-16T09:06:49,479 copying AdaptivePELE/simulation/simulationTypes.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/simulation 2023-10-16T09:06:49,481 copying AdaptivePELE/simulation/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/simulation 2023-10-16T09:06:49,483 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants 2023-10-16T09:06:49,484 copying AdaptivePELE/constants/blockNames.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants 2023-10-16T09:06:49,486 copying AdaptivePELE/constants/constants.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants 2023-10-16T09:06:49,488 copying AdaptivePELE/constants/buildEnvironments.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants 2023-10-16T09:06:49,490 copying AdaptivePELE/constants/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants 2023-10-16T09:06:49,491 copying AdaptivePELE/constants/symmetries.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants 2023-10-16T09:06:49,494 creating build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,495 copying AdaptivePELE/freeEnergies/extractCoords.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,497 copying AdaptivePELE/freeEnergies/estimate.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,499 copying AdaptivePELE/freeEnergies/runMarkovChainModel.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,502 copying AdaptivePELE/freeEnergies/calculateDGiterations.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,503 copying AdaptivePELE/freeEnergies/cluster.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,506 copying AdaptivePELE/freeEnergies/writeExtractedCoordsAsPDB.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,507 copying AdaptivePELE/freeEnergies/calculateAdaptiveDGiterations.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,509 copying AdaptivePELE/freeEnergies/checkDetailedBalance.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,511 copying AdaptivePELE/freeEnergies/estimateDGAdaptive.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,513 copying AdaptivePELE/freeEnergies/__init__.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,515 copying AdaptivePELE/freeEnergies/prepareMSMFolders.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,517 copying AdaptivePELE/freeEnergies/extendTrajectories.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,519 copying AdaptivePELE/freeEnergies/estimateDG.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,521 copying AdaptivePELE/freeEnergies/getRepresentativeStructures.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,523 copying AdaptivePELE/freeEnergies/computeDeltaG.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,525 copying AdaptivePELE/freeEnergies/utilitiesFreeEnergies.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,527 copying AdaptivePELE/freeEnergies/computeDGGrid.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,529 copying AdaptivePELE/freeEnergies/ownBuildMSM.py -> build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:06:49,538 running build_ext 2023-10-16T09:06:50,263 Compiling AdaptivePELE/atomset/atomset.pyx because it changed. 2023-10-16T09:06:50,264 [1/1] Cythonizing AdaptivePELE/atomset/atomset.pyx 2023-10-16T09:06:51,339 /usr/local/lib/python3.11/dist-packages/Cython/Compiler/Main.py:384: FutureWarning: Cython directive 'language_level' not set, using '3str' for now (Py3). This has changed from earlier releases! File: /tmp/pip-wheel-9pdhgzqa/adaptivepele_1b2729e943984970bad4b01533c692a0/AdaptivePELE/atomset/atomset.pxd 2023-10-16T09:06:51,339 tree = Parsing.p_module(s, pxd, full_module_name) 2023-10-16T09:06:55,048 building 'AdaptivePELE.atomset.atomset' extension 2023-10-16T09:06:55,049 creating build/temp.linux-armv7l-cpython-311 2023-10-16T09:06:55,049 creating build/temp.linux-armv7l-cpython-311/AdaptivePELE 2023-10-16T09:06:55,050 creating build/temp.linux-armv7l-cpython-311/AdaptivePELE/atomset 2023-10-16T09:06:55,051 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -IAdaptivePELE -IAdaptivePELE/atomset -I/usr/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c AdaptivePELE/atomset/atomset.c -o build/temp.linux-armv7l-cpython-311/AdaptivePELE/atomset/atomset.o 2023-10-16T09:06:55,497 In file included from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-16T09:06:55,497 from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-16T09:06:55,498 from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-16T09:06:55,498 from AdaptivePELE/atomset/atomset.c:1171: 2023-10-16T09:06:55,499 /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2023-10-16T09:06:55,499 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-16T09:06:55,500 | ^~~~~~~ 2023-10-16T09:11:23,783 arm-linux-gnueabihf-gcc -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/AdaptivePELE/atomset/atomset.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset/atomset.cpython-311-arm-linux-gnueabihf.so 2023-10-16T09:11:23,965 Compiling AdaptivePELE/atomset/SymmetryContactMapEvaluator.pyx because it changed. 2023-10-16T09:11:23,966 [1/1] Cythonizing AdaptivePELE/atomset/SymmetryContactMapEvaluator.pyx 2023-10-16T09:11:23,978 /usr/local/lib/python3.11/dist-packages/Cython/Compiler/Main.py:384: FutureWarning: Cython directive 'language_level' not set, using '3str' for now (Py3). This has changed from earlier releases! File: /tmp/pip-wheel-9pdhgzqa/adaptivepele_1b2729e943984970bad4b01533c692a0/AdaptivePELE/atomset/SymmetryContactMapEvaluator.pxd 2023-10-16T09:11:23,978 tree = Parsing.p_module(s, pxd, full_module_name) 2023-10-16T09:11:25,730 building 'AdaptivePELE.atomset.SymmetryContactMapEvaluator' extension 2023-10-16T09:11:25,731 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -IAdaptivePELE -IAdaptivePELE/atomset -I/usr/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c AdaptivePELE/atomset/SymmetryContactMapEvaluator.c -o build/temp.linux-armv7l-cpython-311/AdaptivePELE/atomset/SymmetryContactMapEvaluator.o 2023-10-16T09:11:26,123 In file included from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-16T09:11:26,124 from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-16T09:11:26,125 from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-16T09:11:26,125 from AdaptivePELE/atomset/SymmetryContactMapEvaluator.c:1171: 2023-10-16T09:11:26,126 /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2023-10-16T09:11:26,126 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-16T09:11:26,127 | ^~~~~~~ 2023-10-16T09:11:48,784 arm-linux-gnueabihf-gcc -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/AdaptivePELE/atomset/SymmetryContactMapEvaluator.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset/SymmetryContactMapEvaluator.cpython-311-arm-linux-gnueabihf.so 2023-10-16T09:11:48,922 Compiling AdaptivePELE/atomset/RMSDCalculator.pyx because it changed. 2023-10-16T09:11:48,922 [1/1] Cythonizing AdaptivePELE/atomset/RMSDCalculator.pyx 2023-10-16T09:11:48,934 /usr/local/lib/python3.11/dist-packages/Cython/Compiler/Main.py:384: FutureWarning: Cython directive 'language_level' not set, using '3str' for now (Py3). This has changed from earlier releases! File: /tmp/pip-wheel-9pdhgzqa/adaptivepele_1b2729e943984970bad4b01533c692a0/AdaptivePELE/atomset/RMSDCalculator.pxd 2023-10-16T09:11:48,935 tree = Parsing.p_module(s, pxd, full_module_name) 2023-10-16T09:11:50,263 building 'AdaptivePELE.atomset.RMSDCalculator' extension 2023-10-16T09:11:50,264 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -IAdaptivePELE -IAdaptivePELE/atomset -I/usr/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c AdaptivePELE/atomset/RMSDCalculator.c -o build/temp.linux-armv7l-cpython-311/AdaptivePELE/atomset/RMSDCalculator.o 2023-10-16T09:11:50,650 In file included from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-16T09:11:50,651 from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-16T09:11:50,651 from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-16T09:11:50,652 from AdaptivePELE/atomset/RMSDCalculator.c:1171: 2023-10-16T09:11:50,653 /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2023-10-16T09:11:50,653 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-16T09:11:50,654 | ^~~~~~~ 2023-10-16T09:12:02,618 arm-linux-gnueabihf-gcc -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/AdaptivePELE/atomset/RMSDCalculator.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset/RMSDCalculator.cpython-311-arm-linux-gnueabihf.so 2023-10-16T09:12:02,776 Compiling AdaptivePELE/freeEnergies/utils.pyx because it changed. 2023-10-16T09:12:02,776 [1/1] Cythonizing AdaptivePELE/freeEnergies/utils.pyx 2023-10-16T09:12:07,247 building 'AdaptivePELE.freeEnergies.utils' extension 2023-10-16T09:12:07,248 creating build/temp.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies 2023-10-16T09:12:07,248 arm-linux-gnueabihf-gcc -Wsign-compare -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -g -fwrapv -O2 -fPIC -IAdaptivePELE -IAdaptivePELE/freeEnergies -I/usr/local/lib/python3.11/dist-packages/numpy/core/include -I/usr/include/python3.11 -c AdaptivePELE/freeEnergies/utils.c -o build/temp.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/utils.o 2023-10-16T09:12:07,649 In file included from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1929, 2023-10-16T09:12:07,650 from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2023-10-16T09:12:07,651 from /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/arrayobject.h:5, 2023-10-16T09:12:07,651 from AdaptivePELE/freeEnergies/utils.c:1171: 2023-10-16T09:12:07,652 /usr/local/lib/python3.11/dist-packages/numpy/core/include/numpy/npy_1_7_deprecated_api.h:17:2: warning: #warning "Using deprecated NumPy API, disable it with " "#define NPY_NO_DEPRECATED_API NPY_1_7_API_VERSION" [-Wcpp] 2023-10-16T09:12:07,652 17 | #warning "Using deprecated NumPy API, disable it with " \ 2023-10-16T09:12:07,652 | ^~~~~~~ 2023-10-16T09:12:38,943 arm-linux-gnueabihf-gcc -shared -Wl,-O1 -Wl,-Bsymbolic-functions -g -fwrapv -O2 build/temp.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/utils.o -L/usr/lib/arm-linux-gnueabihf -o build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/utils.cpython-311-arm-linux-gnueabihf.so 2023-10-16T09:12:39,124 /usr/local/lib/python3.11/dist-packages/setuptools/_distutils/cmd.py:66: SetuptoolsDeprecationWarning: setup.py install is deprecated. 2023-10-16T09:12:39,125 !! 2023-10-16T09:12:39,126 ******************************************************************************** 2023-10-16T09:12:39,126 Please avoid running ``setup.py`` directly. 2023-10-16T09:12:39,127 Instead, use pypa/build, pypa/installer or other 2023-10-16T09:12:39,127 standards-based tools. 2023-10-16T09:12:39,128 See https://blog.ganssle.io/articles/2021/10/setup-py-deprecated.html for details. 2023-10-16T09:12:39,129 ******************************************************************************** 2023-10-16T09:12:39,130 !! 2023-10-16T09:12:39,130 self.initialize_options() 2023-10-16T09:12:39,150 installing to build/bdist.linux-armv7l/wheel 2023-10-16T09:12:39,150 running install 2023-10-16T09:12:39,175 running install_lib 2023-10-16T09:12:39,200 creating build/bdist.linux-armv7l 2023-10-16T09:12:39,201 creating build/bdist.linux-armv7l/wheel 2023-10-16T09:12:39,202 creating build/bdist.linux-armv7l/wheel/AdaptivePELE 2023-10-16T09:12:39,204 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,205 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/testReporter.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,207 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/testClustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,209 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/testMD.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,212 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/testSpawning.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,214 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/testDensityCalculator.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,217 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/testMD_CUDA.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,219 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/testAdaptiveSampling.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,221 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,223 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/testAtomset.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,226 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/testSimulationRunner.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,227 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/tests/testThresholdcalculator.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2023-10-16T09:12:39,230 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/adaptiveSampling.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE 2023-10-16T09:12:39,233 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,234 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/networkCM.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,236 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/pathwayRMSD.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,238 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/addRejectedSteps.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,240 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/writeClusteringStructures.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,242 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/dehidratate_and_align.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,243 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/clusterAdaptiveRun.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,246 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/unbinding.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,247 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/convertTrajectory.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,249 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/interactivePlot.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,252 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/cluster.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,255 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/filter_by_radius.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,257 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/analysis_utils.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,259 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/makeRMSDClustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,261 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/selectOnPlot.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,263 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/plotSpawningClusters.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,265 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/standarize_MD_energies.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,267 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/autoCorrelation.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,270 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/makePNGs.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,271 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/generateBox.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,274 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/findfirstbindingevent.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,275 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/plotRMSF.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,277 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/identifyClusterSnapshot.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,279 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/analyse.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,281 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/clusters_lagtime_grid.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,283 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/writeNetworkFiles.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,285 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/plotAdaptive.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,287 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/simple_postprocessing.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,289 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/histCM.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,291 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/plot3DNetwork.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,293 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/numberOfClusters.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,295 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/extract_ligand_traj.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,297 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,298 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/bestStructs.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,300 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/splitTrajectory.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,302 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/writeTrajToSnapshot.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,304 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/crossValidationClustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,306 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/count_clusters.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,308 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/correctRMSD.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,310 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/compareClustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,313 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/calculateSASAvalues.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,315 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/reportSimulation.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,317 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/simulationToCsv.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,319 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/analyseClustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,321 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/foldersFirstBindingEvent.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,323 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/trajectory_processing.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,325 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/backtrackAdaptiveTrajectory.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,327 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/analysis/calculateDistances.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2023-10-16T09:12:39,330 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2023-10-16T09:12:39,331 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering/thresholdcalculatortypes.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2023-10-16T09:12:39,333 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering/thresholdcalculator.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2023-10-16T09:12:39,335 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering/clustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2023-10-16T09:12:39,340 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering/clusteringTypes.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2023-10-16T09:12:39,342 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/clustering/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2023-10-16T09:12:39,344 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2023-10-16T09:12:39,345 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning/densitycalculator.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2023-10-16T09:12:39,347 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning/spawning.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2023-10-16T09:12:39,351 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning/spawningTypes.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2023-10-16T09:12:39,353 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2023-10-16T09:12:39,355 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/spawning/densitycalculatortypes.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2023-10-16T09:12:39,356 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/makeRelease.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE 2023-10-16T09:12:39,359 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/validator 2023-10-16T09:12:39,360 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/validator/controlFileValidator.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/validator 2023-10-16T09:12:39,362 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/validator/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/validator 2023-10-16T09:12:39,364 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/validator/validatorBlockNames.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/validator 2023-10-16T09:12:39,366 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/runAllTests.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE 2023-10-16T09:12:39,368 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2023-10-16T09:12:39,369 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities/generate_topology_object.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2023-10-16T09:12:39,371 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities/utilities.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2023-10-16T09:12:39,374 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities/clusteringUtilities.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2023-10-16T09:12:39,376 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities/PDBLoader.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2023-10-16T09:12:39,379 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities/conda_deployment.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2023-10-16T09:12:39,380 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2023-10-16T09:12:39,382 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/utilities/synchronization.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2023-10-16T09:12:39,384 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/automateRoundsAdaptive.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE 2023-10-16T09:12:39,387 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2023-10-16T09:12:39,388 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset/atomset.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2023-10-16T09:12:39,419 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2023-10-16T09:12:39,421 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset/setup.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2023-10-16T09:12:39,423 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset/RMSDCalculator.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2023-10-16T09:12:39,432 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/atomset/SymmetryContactMapEvaluator.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2023-10-16T09:12:39,459 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/simulation 2023-10-16T09:12:39,460 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/simulation/openmm_simulations.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/simulation 2023-10-16T09:12:39,463 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/simulation/simulationrunner.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/simulation 2023-10-16T09:12:39,466 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/simulation/simulationTypes.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/simulation 2023-10-16T09:12:39,468 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/simulation/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/simulation 2023-10-16T09:12:39,470 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2023-10-16T09:12:39,471 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants/blockNames.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2023-10-16T09:12:39,473 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants/constants.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2023-10-16T09:12:39,475 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants/buildEnvironments.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2023-10-16T09:12:39,477 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2023-10-16T09:12:39,479 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/constants/symmetries.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2023-10-16T09:12:39,480 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE 2023-10-16T09:12:39,483 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,484 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/extractCoords.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,486 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/utils.cpython-311-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,513 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/estimate.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,516 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/runMarkovChainModel.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,518 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/calculateDGiterations.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,521 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/cluster.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,523 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/writeExtractedCoordsAsPDB.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,526 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/calculateAdaptiveDGiterations.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,528 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/checkDetailedBalance.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,530 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/estimateDGAdaptive.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,532 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,534 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/prepareMSMFolders.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,536 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/extendTrajectories.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,539 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/estimateDG.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,542 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/getRepresentativeStructures.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,544 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/computeDeltaG.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,546 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/utilitiesFreeEnergies.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,549 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/computeDGGrid.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,552 copying build/lib.linux-armv7l-cpython-311/AdaptivePELE/freeEnergies/ownBuildMSM.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2023-10-16T09:12:39,554 running install_egg_info 2023-10-16T09:12:39,628 running egg_info 2023-10-16T09:12:39,652 writing AdaptivePELE.egg-info/PKG-INFO 2023-10-16T09:12:39,655 writing dependency_links to AdaptivePELE.egg-info/dependency_links.txt 2023-10-16T09:12:39,657 writing requirements to AdaptivePELE.egg-info/requires.txt 2023-10-16T09:12:39,658 writing top-level names to AdaptivePELE.egg-info/top_level.txt 2023-10-16T09:12:39,706 reading manifest file 'AdaptivePELE.egg-info/SOURCES.txt' 2023-10-16T09:12:39,711 reading manifest template 'MANIFEST.in' 2023-10-16T09:12:39,730 warning: no files found matching 'utils*.so' under directory 'AdaptivePELE/freeEnergies' 2023-10-16T09:12:39,731 adding license file 'LICENSE' 2023-10-16T09:12:39,737 writing manifest file 'AdaptivePELE.egg-info/SOURCES.txt' 2023-10-16T09:12:39,739 Copying AdaptivePELE.egg-info to build/bdist.linux-armv7l/wheel/AdaptivePELE-1.7.4-py3.11.egg-info 2023-10-16T09:12:39,750 running install_scripts 2023-10-16T09:12:39,804 creating build/bdist.linux-armv7l/wheel/AdaptivePELE-1.7.4.dist-info/WHEEL 2023-10-16T09:12:39,807 creating '/tmp/pip-wheel-6mi225i2/AdaptivePELE-1.7.4-cp311-cp311-linux_armv7l.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2023-10-16T09:12:39,809 adding 'AdaptivePELE/__init__.py' 2023-10-16T09:12:39,814 adding 'AdaptivePELE/adaptiveSampling.py' 2023-10-16T09:12:39,816 adding 'AdaptivePELE/automateRoundsAdaptive.py' 2023-10-16T09:12:39,817 adding 'AdaptivePELE/makeRelease.py' 2023-10-16T09:12:39,819 adding 'AdaptivePELE/runAllTests.py' 2023-10-16T09:12:39,822 adding 'AdaptivePELE/analysis/__init__.py' 2023-10-16T09:12:39,824 adding 'AdaptivePELE/analysis/addRejectedSteps.py' 2023-10-16T09:12:39,825 adding 'AdaptivePELE/analysis/analyse.py' 2023-10-16T09:12:39,827 adding 'AdaptivePELE/analysis/analyseClustering.py' 2023-10-16T09:12:39,828 adding 'AdaptivePELE/analysis/analysis_utils.py' 2023-10-16T09:12:39,830 adding 'AdaptivePELE/analysis/autoCorrelation.py' 2023-10-16T09:12:39,832 adding 'AdaptivePELE/analysis/backtrackAdaptiveTrajectory.py' 2023-10-16T09:12:39,833 adding 'AdaptivePELE/analysis/bestStructs.py' 2023-10-16T09:12:39,835 adding 'AdaptivePELE/analysis/calculateDistances.py' 2023-10-16T09:12:39,837 adding 'AdaptivePELE/analysis/calculateSASAvalues.py' 2023-10-16T09:12:39,839 adding 'AdaptivePELE/analysis/cluster.py' 2023-10-16T09:12:39,841 adding 'AdaptivePELE/analysis/clusterAdaptiveRun.py' 2023-10-16T09:12:39,843 adding 'AdaptivePELE/analysis/clusters_lagtime_grid.py' 2023-10-16T09:12:39,844 adding 'AdaptivePELE/analysis/compareClustering.py' 2023-10-16T09:12:39,846 adding 'AdaptivePELE/analysis/convertTrajectory.py' 2023-10-16T09:12:39,847 adding 'AdaptivePELE/analysis/correctRMSD.py' 2023-10-16T09:12:39,849 adding 'AdaptivePELE/analysis/count_clusters.py' 2023-10-16T09:12:39,850 adding 'AdaptivePELE/analysis/crossValidationClustering.py' 2023-10-16T09:12:39,852 adding 'AdaptivePELE/analysis/dehidratate_and_align.py' 2023-10-16T09:12:39,853 adding 'AdaptivePELE/analysis/extract_ligand_traj.py' 2023-10-16T09:12:39,855 adding 'AdaptivePELE/analysis/filter_by_radius.py' 2023-10-16T09:12:39,856 adding 'AdaptivePELE/analysis/findfirstbindingevent.py' 2023-10-16T09:12:39,857 adding 'AdaptivePELE/analysis/foldersFirstBindingEvent.py' 2023-10-16T09:12:39,859 adding 'AdaptivePELE/analysis/generateBox.py' 2023-10-16T09:12:39,860 adding 'AdaptivePELE/analysis/histCM.py' 2023-10-16T09:12:39,862 adding 'AdaptivePELE/analysis/identifyClusterSnapshot.py' 2023-10-16T09:12:39,864 adding 'AdaptivePELE/analysis/interactivePlot.py' 2023-10-16T09:12:39,866 adding 'AdaptivePELE/analysis/makePNGs.py' 2023-10-16T09:12:39,868 adding 'AdaptivePELE/analysis/makeRMSDClustering.py' 2023-10-16T09:12:39,869 adding 'AdaptivePELE/analysis/networkCM.py' 2023-10-16T09:12:39,871 adding 'AdaptivePELE/analysis/numberOfClusters.py' 2023-10-16T09:12:39,872 adding 'AdaptivePELE/analysis/pathwayRMSD.py' 2023-10-16T09:12:39,874 adding 'AdaptivePELE/analysis/plot3DNetwork.py' 2023-10-16T09:12:39,876 adding 'AdaptivePELE/analysis/plotAdaptive.py' 2023-10-16T09:12:39,878 adding 'AdaptivePELE/analysis/plotRMSF.py' 2023-10-16T09:12:39,879 adding 'AdaptivePELE/analysis/plotSpawningClusters.py' 2023-10-16T09:12:39,881 adding 'AdaptivePELE/analysis/reportSimulation.py' 2023-10-16T09:12:39,883 adding 'AdaptivePELE/analysis/selectOnPlot.py' 2023-10-16T09:12:39,884 adding 'AdaptivePELE/analysis/simple_postprocessing.py' 2023-10-16T09:12:39,886 adding 'AdaptivePELE/analysis/simulationToCsv.py' 2023-10-16T09:12:39,887 adding 'AdaptivePELE/analysis/splitTrajectory.py' 2023-10-16T09:12:39,889 adding 'AdaptivePELE/analysis/standarize_MD_energies.py' 2023-10-16T09:12:39,890 adding 'AdaptivePELE/analysis/trajectory_processing.py' 2023-10-16T09:12:39,892 adding 'AdaptivePELE/analysis/unbinding.py' 2023-10-16T09:12:39,893 adding 'AdaptivePELE/analysis/writeClusteringStructures.py' 2023-10-16T09:12:39,894 adding 'AdaptivePELE/analysis/writeNetworkFiles.py' 2023-10-16T09:12:39,895 adding 'AdaptivePELE/analysis/writeTrajToSnapshot.py' 2023-10-16T09:12:40,003 adding 'AdaptivePELE/atomset/RMSDCalculator.cpython-311-arm-linux-gnueabihf.so' 2023-10-16T09:12:40,191 adding 'AdaptivePELE/atomset/SymmetryContactMapEvaluator.cpython-311-arm-linux-gnueabihf.so' 2023-10-16T09:12:40,199 adding 'AdaptivePELE/atomset/__init__.py' 2023-10-16T09:12:40,582 adding 'AdaptivePELE/atomset/atomset.cpython-311-arm-linux-gnueabihf.so' 2023-10-16T09:12:40,599 adding 'AdaptivePELE/atomset/setup.py' 2023-10-16T09:12:40,601 adding 'AdaptivePELE/clustering/__init__.py' 2023-10-16T09:12:40,610 adding 'AdaptivePELE/clustering/clustering.py' 2023-10-16T09:12:40,612 adding 'AdaptivePELE/clustering/clusteringTypes.py' 2023-10-16T09:12:40,614 adding 'AdaptivePELE/clustering/thresholdcalculator.py' 2023-10-16T09:12:40,615 adding 'AdaptivePELE/clustering/thresholdcalculatortypes.py' 2023-10-16T09:12:40,617 adding 'AdaptivePELE/constants/__init__.py' 2023-10-16T09:12:40,618 adding 'AdaptivePELE/constants/blockNames.py' 2023-10-16T09:12:40,620 adding 'AdaptivePELE/constants/buildEnvironments.py' 2023-10-16T09:12:40,621 adding 'AdaptivePELE/constants/constants.py' 2023-10-16T09:12:40,622 adding 'AdaptivePELE/constants/symmetries.py' 2023-10-16T09:12:40,624 adding 'AdaptivePELE/freeEnergies/__init__.py' 2023-10-16T09:12:40,625 adding 'AdaptivePELE/freeEnergies/calculateAdaptiveDGiterations.py' 2023-10-16T09:12:40,626 adding 'AdaptivePELE/freeEnergies/calculateDGiterations.py' 2023-10-16T09:12:40,628 adding 'AdaptivePELE/freeEnergies/checkDetailedBalance.py' 2023-10-16T09:12:40,630 adding 'AdaptivePELE/freeEnergies/cluster.py' 2023-10-16T09:12:40,631 adding 'AdaptivePELE/freeEnergies/computeDGGrid.py' 2023-10-16T09:12:40,633 adding 'AdaptivePELE/freeEnergies/computeDeltaG.py' 2023-10-16T09:12:40,635 adding 'AdaptivePELE/freeEnergies/estimate.py' 2023-10-16T09:12:40,637 adding 'AdaptivePELE/freeEnergies/estimateDG.py' 2023-10-16T09:12:40,639 adding 'AdaptivePELE/freeEnergies/estimateDGAdaptive.py' 2023-10-16T09:12:40,640 adding 'AdaptivePELE/freeEnergies/extendTrajectories.py' 2023-10-16T09:12:40,644 adding 'AdaptivePELE/freeEnergies/extractCoords.py' 2023-10-16T09:12:40,646 adding 'AdaptivePELE/freeEnergies/getRepresentativeStructures.py' 2023-10-16T09:12:40,647 adding 'AdaptivePELE/freeEnergies/ownBuildMSM.py' 2023-10-16T09:12:40,648 adding 'AdaptivePELE/freeEnergies/prepareMSMFolders.py' 2023-10-16T09:12:40,650 adding 'AdaptivePELE/freeEnergies/runMarkovChainModel.py' 2023-10-16T09:12:40,651 adding 'AdaptivePELE/freeEnergies/utilitiesFreeEnergies.py' 2023-10-16T09:12:40,885 adding 'AdaptivePELE/freeEnergies/utils.cpython-311-arm-linux-gnueabihf.so' 2023-10-16T09:12:40,895 adding 'AdaptivePELE/freeEnergies/writeExtractedCoordsAsPDB.py' 2023-10-16T09:12:40,897 adding 'AdaptivePELE/simulation/__init__.py' 2023-10-16T09:12:40,901 adding 'AdaptivePELE/simulation/openmm_simulations.py' 2023-10-16T09:12:40,902 adding 'AdaptivePELE/simulation/simulationTypes.py' 2023-10-16T09:12:40,911 adding 'AdaptivePELE/simulation/simulationrunner.py' 2023-10-16T09:12:40,914 adding 'AdaptivePELE/spawning/__init__.py' 2023-10-16T09:12:40,915 adding 'AdaptivePELE/spawning/densitycalculator.py' 2023-10-16T09:12:40,916 adding 'AdaptivePELE/spawning/densitycalculatortypes.py' 2023-10-16T09:12:40,922 adding 'AdaptivePELE/spawning/spawning.py' 2023-10-16T09:12:40,924 adding 'AdaptivePELE/spawning/spawningTypes.py' 2023-10-16T09:12:40,926 adding 'AdaptivePELE/tests/__init__.py' 2023-10-16T09:12:40,928 adding 'AdaptivePELE/tests/testAdaptiveSampling.py' 2023-10-16T09:12:40,930 adding 'AdaptivePELE/tests/testAtomset.py' 2023-10-16T09:12:40,932 adding 'AdaptivePELE/tests/testClustering.py' 2023-10-16T09:12:40,933 adding 'AdaptivePELE/tests/testDensityCalculator.py' 2023-10-16T09:12:40,934 adding 'AdaptivePELE/tests/testMD.py' 2023-10-16T09:12:40,936 adding 'AdaptivePELE/tests/testMD_CUDA.py' 2023-10-16T09:12:40,937 adding 'AdaptivePELE/tests/testReporter.py' 2023-10-16T09:12:40,938 adding 'AdaptivePELE/tests/testSimulationRunner.py' 2023-10-16T09:12:40,940 adding 'AdaptivePELE/tests/testSpawning.py' 2023-10-16T09:12:40,942 adding 'AdaptivePELE/tests/testThresholdcalculator.py' 2023-10-16T09:12:40,946 adding 'AdaptivePELE/utilities/PDBLoader.py' 2023-10-16T09:12:40,947 adding 'AdaptivePELE/utilities/__init__.py' 2023-10-16T09:12:40,948 adding 'AdaptivePELE/utilities/clusteringUtilities.py' 2023-10-16T09:12:40,950 adding 'AdaptivePELE/utilities/conda_deployment.py' 2023-10-16T09:12:40,951 adding 'AdaptivePELE/utilities/generate_topology_object.py' 2023-10-16T09:12:40,953 adding 'AdaptivePELE/utilities/synchronization.py' 2023-10-16T09:12:40,958 adding 'AdaptivePELE/utilities/utilities.py' 2023-10-16T09:12:40,959 adding 'AdaptivePELE/validator/__init__.py' 2023-10-16T09:12:40,961 adding 'AdaptivePELE/validator/controlFileValidator.py' 2023-10-16T09:12:40,963 adding 'AdaptivePELE/validator/validatorBlockNames.py' 2023-10-16T09:12:40,965 adding 'AdaptivePELE-1.7.4.dist-info/LICENSE' 2023-10-16T09:12:40,966 adding 'AdaptivePELE-1.7.4.dist-info/METADATA' 2023-10-16T09:12:40,967 adding 'AdaptivePELE-1.7.4.dist-info/WHEEL' 2023-10-16T09:12:40,968 adding 'AdaptivePELE-1.7.4.dist-info/top_level.txt' 2023-10-16T09:12:40,970 adding 'AdaptivePELE-1.7.4.dist-info/RECORD' 2023-10-16T09:12:40,994 removing build/bdist.linux-armv7l/wheel 2023-10-16T09:12:41,555 Building wheel for adaptivepele (setup.py): finished with status 'done' 2023-10-16T09:12:41,584 Created wheel for adaptivepele: filename=AdaptivePELE-1.7.4-cp311-cp311-linux_armv7l.whl size=2096568 sha256=8322937309a7efabf90fbc15d3d59ca9db71870cd9bb872bc4fefc2548447801 2023-10-16T09:12:41,585 Stored in directory: /tmp/pip-ephem-wheel-cache-pc9vr29b/wheels/03/88/52/d4c8aee53385e1c2880f20b149d80df67cb38e3849d4acea93 2023-10-16T09:12:41,599 Successfully built adaptivepele 2023-10-16T09:12:41,669 Removed build tracker: '/tmp/pip-build-tracker-v5lhwghk'