2021-05-14T13:02:48,168 Created temporary directory: /tmp/pip-ephem-wheel-cache-b7ayjpce 2021-05-14T13:02:48,172 Created temporary directory: /tmp/pip-req-tracker-37lkp5c2 2021-05-14T13:02:48,173 Initialized build tracking at /tmp/pip-req-tracker-37lkp5c2 2021-05-14T13:02:48,173 Created build tracker: /tmp/pip-req-tracker-37lkp5c2 2021-05-14T13:02:48,173 Entered build tracker: /tmp/pip-req-tracker-37lkp5c2 2021-05-14T13:02:48,174 Created temporary directory: /tmp/pip-wheel-cikphzo1 2021-05-14T13:02:48,208 1 location(s) to search for versions of adaptivepele: 2021-05-14T13:02:48,208 * https://pypi.org/simple/adaptivepele/ 2021-05-14T13:02:48,208 Fetching project page and analyzing links: https://pypi.org/simple/adaptivepele/ 2021-05-14T13:02:48,209 Getting page https://pypi.org/simple/adaptivepele/ 2021-05-14T13:02:48,210 Found index url https://pypi.org/simple 2021-05-14T13:02:48,299 Found link https://files.pythonhosted.org/packages/33/ee/476a691d254663e61362e5c2754180ff0b92980e6db1afc829265f001706/AdaptivePELE-1.5.1.tar.gz#sha256=5f96081e47a08fa4040ba21a477ba77d590f7feba4980aef9468305fe9f5f282 (from https://pypi.org/simple/adaptivepele/), version: 1.5.1 2021-05-14T13:02:48,299 Found link https://files.pythonhosted.org/packages/d9/82/be65cbae39642401f6e6923e5511fd466d107920ee9673bb84581a243a4e/AdaptivePELE-1.5.2.tar.gz#sha256=7df75c5c57821492d1ba86e44d41b65e6a9105afe6048e85e993741579683848 (from https://pypi.org/simple/adaptivepele/), version: 1.5.2 2021-05-14T13:02:48,299 Found link https://files.pythonhosted.org/packages/48/3b/f12bfdcfd7f0fdcb2f58d659ff94c26666767eec4ca8454750a3241c395e/AdaptivePELE-1.6.tar.gz#sha256=afc51a35222361e6c0caf880e1d52e91b5658dbe4740f82a3460a97ebaa48bf5 (from https://pypi.org/simple/adaptivepele/), version: 1.6 2021-05-14T13:02:48,300 Found link https://files.pythonhosted.org/packages/d0/1b/f731952d133f4a684ae4376f67513af80d1f759b9ef4d6137767e0fc8ed9/AdaptivePELE-1.6.2.tar.gz#sha256=01891c877f6615a876c61c6bf1d68930d4af63750eb3f1a4e7e23ff0f962bbd5 (from https://pypi.org/simple/adaptivepele/), version: 1.6.2 2021-05-14T13:02:48,300 Found link https://files.pythonhosted.org/packages/25/2c/65b787dc210294855b8f27abeb4a7761f25fce34e0b8bfd56779c679440d/AdaptivePELE-1.6.3.tar.gz#sha256=34be232bc04bde2dcc4ebd900dd9c71e6f25eed93b7c875463c07d3dd8ce1aa9 (from https://pypi.org/simple/adaptivepele/), version: 1.6.3 2021-05-14T13:02:48,300 Found link https://files.pythonhosted.org/packages/2b/34/d4545814438fa2992d83f5be0389f6465ab3e542ada0c02f90dbc4cc5695/AdaptivePELE-1.7.tar.gz#sha256=21d8643eb2fbf9ffe733a996fa8851cd569d9ca6f77f303211813eeb856bc5eb (from https://pypi.org/simple/adaptivepele/), version: 1.7 2021-05-14T13:02:48,300 Found link https://files.pythonhosted.org/packages/21/7d/8c8eb27cbe21dfcfbf80d5f16c889ee2d5bf0eec8dd8bcd03567d06bef98/AdaptivePELE-1.7.1.tar.gz#sha256=4d6c1a5eecbc779828f162541ee7e308190152c4a871569d66fb3f7ab0673155 (from https://pypi.org/simple/adaptivepele/), version: 1.7.1 2021-05-14T13:02:48,301 Skipping link: not a file: https://pypi.org/simple/adaptivepele/ 2021-05-14T13:02:48,315 Given no hashes to check 1 links for project 'adaptivepele': discarding no candidates 2021-05-14T13:02:48,330 Collecting adaptivepele==1.7.1 2021-05-14T13:02:48,332 Created temporary directory: /tmp/pip-unpack-778r4m2s 2021-05-14T13:02:48,376 Downloading AdaptivePELE-1.7.1.tar.gz (3.0 MB) 2021-05-14T13:02:49,546 Added adaptivepele==1.7.1 from https://files.pythonhosted.org/packages/21/7d/8c8eb27cbe21dfcfbf80d5f16c889ee2d5bf0eec8dd8bcd03567d06bef98/AdaptivePELE-1.7.1.tar.gz#sha256=4d6c1a5eecbc779828f162541ee7e308190152c4a871569d66fb3f7ab0673155 to build tracker '/tmp/pip-req-tracker-37lkp5c2' 2021-05-14T13:02:49,547 Running setup.py (path:/tmp/pip-wheel-cikphzo1/adaptivepele_f8ebe87ac49a4a5d8d7b9edcf44d6db9/setup.py) egg_info for package adaptivepele 2021-05-14T13:02:49,548 Created temporary directory: /tmp/pip-pip-egg-info-dnwg_jy2 2021-05-14T13:02:49,548 Running command python setup.py egg_info 2021-05-14T13:02:50,935 Warning: 'classifiers' should be a list, got type 'tuple' 2021-05-14T13:02:51,054 running egg_info 2021-05-14T13:02:51,057 creating /tmp/pip-pip-egg-info-dnwg_jy2/AdaptivePELE.egg-info 2021-05-14T13:02:51,058 writing /tmp/pip-pip-egg-info-dnwg_jy2/AdaptivePELE.egg-info/PKG-INFO 2021-05-14T13:02:51,062 writing dependency_links to /tmp/pip-pip-egg-info-dnwg_jy2/AdaptivePELE.egg-info/dependency_links.txt 2021-05-14T13:02:51,064 writing requirements to /tmp/pip-pip-egg-info-dnwg_jy2/AdaptivePELE.egg-info/requires.txt 2021-05-14T13:02:51,065 writing top-level names to /tmp/pip-pip-egg-info-dnwg_jy2/AdaptivePELE.egg-info/top_level.txt 2021-05-14T13:02:51,067 writing manifest file '/tmp/pip-pip-egg-info-dnwg_jy2/AdaptivePELE.egg-info/SOURCES.txt' 2021-05-14T13:02:51,215 reading manifest file '/tmp/pip-pip-egg-info-dnwg_jy2/AdaptivePELE.egg-info/SOURCES.txt' 2021-05-14T13:02:51,217 reading manifest template 'MANIFEST.in' 2021-05-14T13:02:51,264 writing manifest file '/tmp/pip-pip-egg-info-dnwg_jy2/AdaptivePELE.egg-info/SOURCES.txt' 2021-05-14T13:02:51,367 Source in /tmp/pip-wheel-cikphzo1/adaptivepele_f8ebe87ac49a4a5d8d7b9edcf44d6db9 has version 1.7.1, which satisfies requirement adaptivepele==1.7.1 from https://files.pythonhosted.org/packages/21/7d/8c8eb27cbe21dfcfbf80d5f16c889ee2d5bf0eec8dd8bcd03567d06bef98/AdaptivePELE-1.7.1.tar.gz#sha256=4d6c1a5eecbc779828f162541ee7e308190152c4a871569d66fb3f7ab0673155 2021-05-14T13:02:51,368 Removed adaptivepele==1.7.1 from https://files.pythonhosted.org/packages/21/7d/8c8eb27cbe21dfcfbf80d5f16c889ee2d5bf0eec8dd8bcd03567d06bef98/AdaptivePELE-1.7.1.tar.gz#sha256=4d6c1a5eecbc779828f162541ee7e308190152c4a871569d66fb3f7ab0673155 from build tracker '/tmp/pip-req-tracker-37lkp5c2' 2021-05-14T13:02:51,373 Created temporary directory: /tmp/pip-unpack-dsut1y1z 2021-05-14T13:02:51,373 Building wheels for collected packages: adaptivepele 2021-05-14T13:02:51,378 Created temporary directory: /tmp/pip-wheel-842el24b 2021-05-14T13:02:51,379 Building wheel for adaptivepele (setup.py): started 2021-05-14T13:02:51,379 Destination directory: /tmp/pip-wheel-842el24b 2021-05-14T13:02:51,379 Running command /usr/bin/python3 -u -c 'import io, os, sys, setuptools, tokenize; sys.argv[0] = '"'"'/tmp/pip-wheel-cikphzo1/adaptivepele_f8ebe87ac49a4a5d8d7b9edcf44d6db9/setup.py'"'"'; __file__='"'"'/tmp/pip-wheel-cikphzo1/adaptivepele_f8ebe87ac49a4a5d8d7b9edcf44d6db9/setup.py'"'"';f = getattr(tokenize, '"'"'open'"'"', open)(__file__) if os.path.exists(__file__) else io.StringIO('"'"'from setuptools import setup; setup()'"'"');code = f.read().replace('"'"'\r\n'"'"', '"'"'\n'"'"');f.close();exec(compile(code, __file__, '"'"'exec'"'"'))' bdist_wheel -d /tmp/pip-wheel-842el24b 2021-05-14T13:02:52,925 Warning: 'classifiers' should be a list, got type 'tuple' 2021-05-14T13:02:53,055 running bdist_wheel 2021-05-14T13:02:53,060 running build 2021-05-14T13:02:53,060 running build_py 2021-05-14T13:02:53,184 creating build 2021-05-14T13:02:53,184 creating build/lib.linux-armv7l-3.7 2021-05-14T13:02:53,185 creating build/lib.linux-armv7l-3.7/AdaptivePELE 2021-05-14T13:02:53,187 copying AdaptivePELE/automateRoundsAdaptive.py -> build/lib.linux-armv7l-3.7/AdaptivePELE 2021-05-14T13:02:53,189 copying AdaptivePELE/makeRelease.py -> build/lib.linux-armv7l-3.7/AdaptivePELE 2021-05-14T13:02:53,192 copying AdaptivePELE/runAllTests.py -> build/lib.linux-armv7l-3.7/AdaptivePELE 2021-05-14T13:02:53,194 copying AdaptivePELE/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE 2021-05-14T13:02:53,196 copying AdaptivePELE/adaptiveSampling.py -> build/lib.linux-armv7l-3.7/AdaptivePELE 2021-05-14T13:02:53,203 creating build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,204 copying AdaptivePELE/analysis/plot3DNetwork.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,206 copying AdaptivePELE/analysis/makePNGs.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,209 copying AdaptivePELE/analysis/correctRMSD.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,211 copying AdaptivePELE/analysis/cluster.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,214 copying AdaptivePELE/analysis/foldersFirstBindingEvent.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,217 copying AdaptivePELE/analysis/reportSimulation.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,219 copying AdaptivePELE/analysis/clusters_lagtime_grid.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,222 copying AdaptivePELE/analysis/bestStructs.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,225 copying AdaptivePELE/analysis/extract_ligand_traj.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,227 copying AdaptivePELE/analysis/compareClustering.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,230 copying AdaptivePELE/analysis/count_clusters.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,233 copying AdaptivePELE/analysis/analysis_utils.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,235 copying AdaptivePELE/analysis/backtrackAdaptiveTrajectory.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,237 copying AdaptivePELE/analysis/filter_by_radius.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,240 copying AdaptivePELE/analysis/trajectory_processing.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,243 copying AdaptivePELE/analysis/autoCorrelation.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,245 copying AdaptivePELE/analysis/pathwayRMSD.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,247 copying AdaptivePELE/analysis/unbinding.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,250 copying AdaptivePELE/analysis/histCM.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,252 copying AdaptivePELE/analysis/analyseClustering.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,254 copying AdaptivePELE/analysis/writeTrajToSnapshot.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,257 copying AdaptivePELE/analysis/plotAdaptive.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,260 copying AdaptivePELE/analysis/plotRMSF.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,262 copying AdaptivePELE/analysis/writeNetworkFiles.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,265 copying AdaptivePELE/analysis/writeClusteringStructures.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,267 copying AdaptivePELE/analysis/plotSpawningClusters.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,269 copying AdaptivePELE/analysis/standarize_MD_energies.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,272 copying AdaptivePELE/analysis/analyse.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,275 copying AdaptivePELE/analysis/interactivePlot.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,277 copying AdaptivePELE/analysis/simple_postprocessing.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,280 copying AdaptivePELE/analysis/selectOnPlot.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,283 copying AdaptivePELE/analysis/networkCM.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,285 copying AdaptivePELE/analysis/calculateSASAvalues.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,288 copying AdaptivePELE/analysis/findfirstbindingevent.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,290 copying AdaptivePELE/analysis/calculateDistances.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,292 copying AdaptivePELE/analysis/splitTrajectory.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,295 copying AdaptivePELE/analysis/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,297 copying AdaptivePELE/analysis/generateBox.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,299 copying AdaptivePELE/analysis/addRejectedSteps.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,302 copying AdaptivePELE/analysis/convertTrajectory.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,304 copying AdaptivePELE/analysis/simulationToCsv.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,306 copying AdaptivePELE/analysis/crossValidationClustering.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,309 copying AdaptivePELE/analysis/numberOfClusters.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,313 copying AdaptivePELE/analysis/dehidratate_and_align.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,315 copying AdaptivePELE/analysis/clusterAdaptiveRun.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,318 copying AdaptivePELE/analysis/identifyClusterSnapshot.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/analysis 2021-05-14T13:02:53,321 creating build/lib.linux-armv7l-3.7/AdaptivePELE/utilities 2021-05-14T13:02:53,322 copying AdaptivePELE/utilities/conda_deployment.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/utilities 2021-05-14T13:02:53,325 copying AdaptivePELE/utilities/generate_topology_object.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/utilities 2021-05-14T13:02:53,327 copying AdaptivePELE/utilities/PDBLoader.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/utilities 2021-05-14T13:02:53,330 copying AdaptivePELE/utilities/utilities.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/utilities 2021-05-14T13:02:53,334 copying AdaptivePELE/utilities/clusteringUtilities.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/utilities 2021-05-14T13:02:53,336 copying AdaptivePELE/utilities/synchronization.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/utilities 2021-05-14T13:02:53,339 copying AdaptivePELE/utilities/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/utilities 2021-05-14T13:02:53,342 creating build/lib.linux-armv7l-3.7/AdaptivePELE/clustering 2021-05-14T13:02:53,343 copying AdaptivePELE/clustering/clusteringTypes.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/clustering 2021-05-14T13:02:53,345 copying AdaptivePELE/clustering/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/clustering 2021-05-14T13:02:53,347 copying AdaptivePELE/clustering/thresholdcalculator.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/clustering 2021-05-14T13:02:53,350 copying AdaptivePELE/clustering/clustering.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/clustering 2021-05-14T13:02:53,354 copying AdaptivePELE/clustering/thresholdcalculatortypes.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/clustering 2021-05-14T13:02:53,357 creating build/lib.linux-armv7l-3.7/AdaptivePELE/constants 2021-05-14T13:02:53,358 copying AdaptivePELE/constants/blockNames.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/constants 2021-05-14T13:02:53,362 copying AdaptivePELE/constants/symmetries.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/constants 2021-05-14T13:02:53,366 copying AdaptivePELE/constants/buildEnvironments.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/constants 2021-05-14T13:02:53,368 copying AdaptivePELE/constants/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/constants 2021-05-14T13:02:53,371 copying AdaptivePELE/constants/constants.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/constants 2021-05-14T13:02:53,374 creating build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,375 copying AdaptivePELE/tests/testReporter.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,378 copying AdaptivePELE/tests/testMD.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,380 copying AdaptivePELE/tests/testAtomset.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,383 copying AdaptivePELE/tests/testMD_CUDA.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,386 copying AdaptivePELE/tests/testClustering.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,388 copying AdaptivePELE/tests/testDensityCalculator.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,391 copying AdaptivePELE/tests/testThresholdcalculator.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,394 copying AdaptivePELE/tests/testAdaptiveSampling.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,396 copying AdaptivePELE/tests/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,398 copying AdaptivePELE/tests/testSpawning.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/tests 2021-05-14T13:02:53,403 creating build/lib.linux-armv7l-3.7/AdaptivePELE/simulation 2021-05-14T13:02:53,404 copying AdaptivePELE/simulation/simulationrunner.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/simulation 2021-05-14T13:02:53,409 copying AdaptivePELE/simulation/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/simulation 2021-05-14T13:02:53,411 copying AdaptivePELE/simulation/simulationTypes.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/simulation 2021-05-14T13:02:53,414 copying AdaptivePELE/simulation/openmm_simulations.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/simulation 2021-05-14T13:02:53,419 creating build/lib.linux-armv7l-3.7/AdaptivePELE/atomset 2021-05-14T13:02:53,420 copying AdaptivePELE/atomset/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/atomset 2021-05-14T13:02:53,423 copying AdaptivePELE/atomset/setup.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/atomset 2021-05-14T13:02:53,428 creating build/lib.linux-armv7l-3.7/AdaptivePELE/validator 2021-05-14T13:02:53,429 copying AdaptivePELE/validator/controlFileValidator.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/validator 2021-05-14T13:02:53,432 copying AdaptivePELE/validator/validatorBlockNames.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/validator 2021-05-14T13:02:53,435 copying AdaptivePELE/validator/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/validator 2021-05-14T13:02:53,438 creating build/lib.linux-armv7l-3.7/AdaptivePELE/spawning 2021-05-14T13:02:53,439 copying AdaptivePELE/spawning/densitycalculatortypes.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/spawning 2021-05-14T13:02:53,442 copying AdaptivePELE/spawning/densitycalculator.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/spawning 2021-05-14T13:02:53,445 copying AdaptivePELE/spawning/spawning.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/spawning 2021-05-14T13:02:53,450 copying AdaptivePELE/spawning/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/spawning 2021-05-14T13:02:53,452 copying AdaptivePELE/spawning/spawningTypes.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/spawning 2021-05-14T13:02:53,457 creating build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,458 copying AdaptivePELE/freeEnergies/ownBuildMSM.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,461 copying AdaptivePELE/freeEnergies/cluster.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,463 copying AdaptivePELE/freeEnergies/estimate.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,466 copying AdaptivePELE/freeEnergies/extractCoords.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,470 copying AdaptivePELE/freeEnergies/extendTrajectories.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,473 copying AdaptivePELE/freeEnergies/getRepresentativeStructures.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,475 copying AdaptivePELE/freeEnergies/estimateDG.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,478 copying AdaptivePELE/freeEnergies/runMarkovChainModel.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,481 copying AdaptivePELE/freeEnergies/utilitiesFreeEnergies.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,483 copying AdaptivePELE/freeEnergies/writeExtractedCoordsAsPDB.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,485 copying AdaptivePELE/freeEnergies/computeDGGrid.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,488 copying AdaptivePELE/freeEnergies/prepareMSMFolders.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,490 copying AdaptivePELE/freeEnergies/checkDetailedBalance.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,493 copying AdaptivePELE/freeEnergies/computeDeltaG.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,496 copying AdaptivePELE/freeEnergies/__init__.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,498 copying AdaptivePELE/freeEnergies/calculateDGiterations.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,500 copying AdaptivePELE/freeEnergies/calculateAdaptiveDGiterations.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,503 copying AdaptivePELE/freeEnergies/estimateDGAdaptive.py -> build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:02:53,518 running build_ext 2021-05-14T13:02:53,524 cythoning AdaptivePELE/atomset/atomset.pyx to AdaptivePELE/atomset/atomset.c 2021-05-14T13:02:54,139 /usr/local/lib/python3.7/dist-packages/Cython/Compiler/Main.py:369: FutureWarning: Cython directive 'language_level' not set, using 2 for now (Py2). This will change in a later release! File: /tmp/pip-wheel-cikphzo1/adaptivepele_f8ebe87ac49a4a5d8d7b9edcf44d6db9/AdaptivePELE/atomset/atomset.pxd 2021-05-14T13:02:54,139 tree = Parsing.p_module(s, pxd, full_module_name) 2021-05-14T13:02:56,551 skipping 'AdaptivePELE/atomset/SymmetryContactMapEvaluator.c' Cython extension (up-to-date) 2021-05-14T13:02:56,552 skipping 'AdaptivePELE/atomset/RMSDCalculator.c' Cython extension (up-to-date) 2021-05-14T13:02:56,553 skipping 'AdaptivePELE/freeEnergies/utils.c' Cython extension (up-to-date) 2021-05-14T13:02:56,554 building 'AdaptivePELE.atomset.atomset' extension 2021-05-14T13:02:56,554 creating build/temp.linux-armv7l-3.7 2021-05-14T13:02:56,555 creating build/temp.linux-armv7l-3.7/AdaptivePELE 2021-05-14T13:02:56,555 creating build/temp.linux-armv7l-3.7/AdaptivePELE/atomset 2021-05-14T13:02:56,556 arm-linux-gnueabihf-gcc -pthread -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fPIC -IAdaptivePELE -IAdaptivePELE/atomset -I/usr/local/lib/python3.7/dist-packages/numpy/core/include -I/usr/include/python3.7m -c AdaptivePELE/atomset/atomset.c -o build/temp.linux-armv7l-3.7/AdaptivePELE/atomset/atomset.o 2021-05-14T13:02:56,991 In file included from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1944, 2021-05-14T13:02:56,991 from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2021-05-14T13:02:56,991 from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/arrayobject.h:4, 2021-05-14T13:02:56,991 from AdaptivePELE/atomset/atomset.c:612: 2021-05-14T13:02:56,992 /usr/local/lib/python3.7/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] 2021-05-14T13:02:56,992 #warning "Using deprecated NumPy API, disable it with " \ 2021-05-14T13:02:56,992 ^~~~~~~ 2021-05-14T13:03:27,426 arm-linux-gnueabihf-gcc -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -Wl,-z,relro -g -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 build/temp.linux-armv7l-3.7/AdaptivePELE/atomset/atomset.o -o build/lib.linux-armv7l-3.7/AdaptivePELE/atomset/atomset.cpython-37m-arm-linux-gnueabihf.so 2021-05-14T13:03:27,684 building 'AdaptivePELE.atomset.SymmetryContactMapEvaluator' extension 2021-05-14T13:03:27,684 arm-linux-gnueabihf-gcc -pthread -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fPIC -IAdaptivePELE -IAdaptivePELE/atomset -I/usr/local/lib/python3.7/dist-packages/numpy/core/include -I/usr/include/python3.7m -c AdaptivePELE/atomset/SymmetryContactMapEvaluator.c -o build/temp.linux-armv7l-3.7/AdaptivePELE/atomset/SymmetryContactMapEvaluator.o 2021-05-14T13:03:28,040 In file included from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1944, 2021-05-14T13:03:28,041 from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2021-05-14T13:03:28,041 from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/arrayobject.h:4, 2021-05-14T13:03:28,041 from AdaptivePELE/atomset/SymmetryContactMapEvaluator.c:610: 2021-05-14T13:03:28,041 /usr/local/lib/python3.7/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] 2021-05-14T13:03:28,041 #warning "Using deprecated NumPy API, disable it with " \ 2021-05-14T13:03:28,041 ^~~~~~~ 2021-05-14T13:03:39,596 arm-linux-gnueabihf-gcc -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -Wl,-z,relro -g -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 build/temp.linux-armv7l-3.7/AdaptivePELE/atomset/SymmetryContactMapEvaluator.o -o build/lib.linux-armv7l-3.7/AdaptivePELE/atomset/SymmetryContactMapEvaluator.cpython-37m-arm-linux-gnueabihf.so 2021-05-14T13:03:39,766 building 'AdaptivePELE.atomset.RMSDCalculator' extension 2021-05-14T13:03:39,767 arm-linux-gnueabihf-gcc -pthread -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fPIC -IAdaptivePELE -IAdaptivePELE/atomset -I/usr/local/lib/python3.7/dist-packages/numpy/core/include -I/usr/include/python3.7m -c AdaptivePELE/atomset/RMSDCalculator.c -o build/temp.linux-armv7l-3.7/AdaptivePELE/atomset/RMSDCalculator.o 2021-05-14T13:03:40,124 In file included from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1944, 2021-05-14T13:03:40,124 from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2021-05-14T13:03:40,124 from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/arrayobject.h:4, 2021-05-14T13:03:40,124 from AdaptivePELE/atomset/RMSDCalculator.c:610: 2021-05-14T13:03:40,124 /usr/local/lib/python3.7/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] 2021-05-14T13:03:40,124 #warning "Using deprecated NumPy API, disable it with " \ 2021-05-14T13:03:40,125 ^~~~~~~ 2021-05-14T13:03:47,335 arm-linux-gnueabihf-gcc -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -Wl,-z,relro -g -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 build/temp.linux-armv7l-3.7/AdaptivePELE/atomset/RMSDCalculator.o -o build/lib.linux-armv7l-3.7/AdaptivePELE/atomset/RMSDCalculator.cpython-37m-arm-linux-gnueabihf.so 2021-05-14T13:03:47,480 building 'AdaptivePELE.freeEnergies.utils' extension 2021-05-14T13:03:47,481 creating build/temp.linux-armv7l-3.7/AdaptivePELE/freeEnergies 2021-05-14T13:03:47,481 arm-linux-gnueabihf-gcc -pthread -DNDEBUG -g -fwrapv -O2 -Wall -g -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 -fPIC -IAdaptivePELE -IAdaptivePELE/freeEnergies -I/usr/local/lib/python3.7/dist-packages/numpy/core/include -I/usr/include/python3.7m -c AdaptivePELE/freeEnergies/utils.c -o build/temp.linux-armv7l-3.7/AdaptivePELE/freeEnergies/utils.o 2021-05-14T13:03:47,860 In file included from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/ndarraytypes.h:1944, 2021-05-14T13:03:47,860 from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/ndarrayobject.h:12, 2021-05-14T13:03:47,860 from /usr/local/lib/python3.7/dist-packages/numpy/core/include/numpy/arrayobject.h:4, 2021-05-14T13:03:47,860 from AdaptivePELE/freeEnergies/utils.c:610: 2021-05-14T13:03:47,861 /usr/local/lib/python3.7/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] 2021-05-14T13:03:47,861 #warning "Using deprecated NumPy API, disable it with " \ 2021-05-14T13:03:47,861 ^~~~~~~ 2021-05-14T13:04:02,452 arm-linux-gnueabihf-gcc -pthread -shared -Wl,-O1 -Wl,-Bsymbolic-functions -Wl,-z,relro -Wl,-z,relro -g -fstack-protector-strong -Wformat -Werror=format-security -Wdate-time -D_FORTIFY_SOURCE=2 build/temp.linux-armv7l-3.7/AdaptivePELE/freeEnergies/utils.o -o build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/utils.cpython-37m-arm-linux-gnueabihf.so 2021-05-14T13:04:02,652 installing to build/bdist.linux-armv7l/wheel 2021-05-14T13:04:02,652 running install 2021-05-14T13:04:02,654 running install_lib 2021-05-14T13:04:02,658 creating build/bdist.linux-armv7l 2021-05-14T13:04:02,659 creating build/bdist.linux-armv7l/wheel 2021-05-14T13:04:02,661 creating build/bdist.linux-armv7l/wheel/AdaptivePELE 2021-05-14T13:04:02,664 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,665 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/plot3DNetwork.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,667 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/makePNGs.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,670 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/correctRMSD.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,673 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/cluster.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,676 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/foldersFirstBindingEvent.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,679 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/reportSimulation.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,681 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/clusters_lagtime_grid.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,684 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/bestStructs.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,687 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/extract_ligand_traj.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,689 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/compareClustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,692 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/count_clusters.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,695 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/analysis_utils.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,697 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/backtrackAdaptiveTrajectory.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,700 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/filter_by_radius.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,702 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/trajectory_processing.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,705 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/autoCorrelation.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,708 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/pathwayRMSD.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,710 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/unbinding.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,713 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/histCM.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,715 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/analyseClustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,718 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/writeTrajToSnapshot.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,720 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/plotAdaptive.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,723 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/plotRMSF.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,726 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/writeNetworkFiles.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,728 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/writeClusteringStructures.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,730 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/plotSpawningClusters.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,733 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/standarize_MD_energies.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,736 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/analyse.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,738 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/interactivePlot.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,741 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/simple_postprocessing.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,743 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/selectOnPlot.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,746 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/networkCM.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,749 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/calculateSASAvalues.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,752 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/findfirstbindingevent.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,754 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/calculateDistances.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,757 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/splitTrajectory.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,759 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,761 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/generateBox.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,764 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/addRejectedSteps.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,766 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/convertTrajectory.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,769 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/simulationToCsv.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,771 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/crossValidationClustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,773 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/numberOfClusters.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,776 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/dehidratate_and_align.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,779 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/clusterAdaptiveRun.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,782 copying build/lib.linux-armv7l-3.7/AdaptivePELE/analysis/identifyClusterSnapshot.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/analysis 2021-05-14T13:04:02,784 copying build/lib.linux-armv7l-3.7/AdaptivePELE/automateRoundsAdaptive.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE 2021-05-14T13:04:02,787 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2021-05-14T13:04:02,788 copying build/lib.linux-armv7l-3.7/AdaptivePELE/utilities/conda_deployment.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2021-05-14T13:04:02,791 copying build/lib.linux-armv7l-3.7/AdaptivePELE/utilities/generate_topology_object.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2021-05-14T13:04:02,793 copying build/lib.linux-armv7l-3.7/AdaptivePELE/utilities/PDBLoader.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2021-05-14T13:04:02,796 copying build/lib.linux-armv7l-3.7/AdaptivePELE/utilities/utilities.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2021-05-14T13:04:02,800 copying build/lib.linux-armv7l-3.7/AdaptivePELE/utilities/clusteringUtilities.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2021-05-14T13:04:02,803 copying build/lib.linux-armv7l-3.7/AdaptivePELE/utilities/synchronization.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2021-05-14T13:04:02,806 copying build/lib.linux-armv7l-3.7/AdaptivePELE/utilities/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/utilities 2021-05-14T13:04:02,809 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2021-05-14T13:04:02,810 copying build/lib.linux-armv7l-3.7/AdaptivePELE/clustering/clusteringTypes.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2021-05-14T13:04:02,813 copying build/lib.linux-armv7l-3.7/AdaptivePELE/clustering/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2021-05-14T13:04:02,815 copying build/lib.linux-armv7l-3.7/AdaptivePELE/clustering/thresholdcalculator.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2021-05-14T13:04:02,817 copying build/lib.linux-armv7l-3.7/AdaptivePELE/clustering/clustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2021-05-14T13:04:02,823 copying build/lib.linux-armv7l-3.7/AdaptivePELE/clustering/thresholdcalculatortypes.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/clustering 2021-05-14T13:04:02,825 copying build/lib.linux-armv7l-3.7/AdaptivePELE/makeRelease.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE 2021-05-14T13:04:02,829 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2021-05-14T13:04:02,831 copying build/lib.linux-armv7l-3.7/AdaptivePELE/constants/blockNames.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2021-05-14T13:04:02,834 copying build/lib.linux-armv7l-3.7/AdaptivePELE/constants/symmetries.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2021-05-14T13:04:02,836 copying build/lib.linux-armv7l-3.7/AdaptivePELE/constants/buildEnvironments.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2021-05-14T13:04:02,839 copying build/lib.linux-armv7l-3.7/AdaptivePELE/constants/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2021-05-14T13:04:02,842 copying build/lib.linux-armv7l-3.7/AdaptivePELE/constants/constants.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/constants 2021-05-14T13:04:02,846 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,847 copying build/lib.linux-armv7l-3.7/AdaptivePELE/tests/testReporter.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,851 copying build/lib.linux-armv7l-3.7/AdaptivePELE/tests/testMD.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,854 copying build/lib.linux-armv7l-3.7/AdaptivePELE/tests/testAtomset.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,858 copying build/lib.linux-armv7l-3.7/AdaptivePELE/tests/testMD_CUDA.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,861 copying build/lib.linux-armv7l-3.7/AdaptivePELE/tests/testClustering.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,864 copying build/lib.linux-armv7l-3.7/AdaptivePELE/tests/testDensityCalculator.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,868 copying build/lib.linux-armv7l-3.7/AdaptivePELE/tests/testThresholdcalculator.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,870 copying build/lib.linux-armv7l-3.7/AdaptivePELE/tests/testAdaptiveSampling.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,874 copying build/lib.linux-armv7l-3.7/AdaptivePELE/tests/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,876 copying build/lib.linux-armv7l-3.7/AdaptivePELE/tests/testSpawning.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/tests 2021-05-14T13:04:02,879 copying build/lib.linux-armv7l-3.7/AdaptivePELE/runAllTests.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE 2021-05-14T13:04:02,883 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/simulation 2021-05-14T13:04:02,885 copying build/lib.linux-armv7l-3.7/AdaptivePELE/simulation/simulationrunner.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/simulation 2021-05-14T13:04:02,890 copying build/lib.linux-armv7l-3.7/AdaptivePELE/simulation/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/simulation 2021-05-14T13:04:02,893 copying build/lib.linux-armv7l-3.7/AdaptivePELE/simulation/simulationTypes.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/simulation 2021-05-14T13:04:02,895 copying build/lib.linux-armv7l-3.7/AdaptivePELE/simulation/openmm_simulations.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/simulation 2021-05-14T13:04:02,900 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2021-05-14T13:04:02,902 copying build/lib.linux-armv7l-3.7/AdaptivePELE/atomset/atomset.cpython-37m-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2021-05-14T13:04:02,945 copying build/lib.linux-armv7l-3.7/AdaptivePELE/atomset/RMSDCalculator.cpython-37m-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2021-05-14T13:04:02,961 copying build/lib.linux-armv7l-3.7/AdaptivePELE/atomset/SymmetryContactMapEvaluator.cpython-37m-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2021-05-14T13:04:02,981 copying build/lib.linux-armv7l-3.7/AdaptivePELE/atomset/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2021-05-14T13:04:02,985 copying build/lib.linux-armv7l-3.7/AdaptivePELE/atomset/setup.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/atomset 2021-05-14T13:04:02,990 copying build/lib.linux-armv7l-3.7/AdaptivePELE/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE 2021-05-14T13:04:02,995 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/validator 2021-05-14T13:04:02,997 copying build/lib.linux-armv7l-3.7/AdaptivePELE/validator/controlFileValidator.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/validator 2021-05-14T13:04:03,000 copying build/lib.linux-armv7l-3.7/AdaptivePELE/validator/validatorBlockNames.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/validator 2021-05-14T13:04:03,004 copying build/lib.linux-armv7l-3.7/AdaptivePELE/validator/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/validator 2021-05-14T13:04:03,006 copying build/lib.linux-armv7l-3.7/AdaptivePELE/adaptiveSampling.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE 2021-05-14T13:04:03,012 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2021-05-14T13:04:03,014 copying build/lib.linux-armv7l-3.7/AdaptivePELE/spawning/densitycalculatortypes.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2021-05-14T13:04:03,020 copying build/lib.linux-armv7l-3.7/AdaptivePELE/spawning/densitycalculator.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2021-05-14T13:04:03,026 copying build/lib.linux-armv7l-3.7/AdaptivePELE/spawning/spawning.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2021-05-14T13:04:03,030 copying build/lib.linux-armv7l-3.7/AdaptivePELE/spawning/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2021-05-14T13:04:03,033 copying build/lib.linux-armv7l-3.7/AdaptivePELE/spawning/spawningTypes.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/spawning 2021-05-14T13:04:03,041 creating build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,044 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/ownBuildMSM.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,048 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/cluster.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,051 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/estimate.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,055 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/extractCoords.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,060 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/extendTrajectories.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,063 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/getRepresentativeStructures.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,066 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/estimateDG.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,071 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/runMarkovChainModel.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,075 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/utilitiesFreeEnergies.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,078 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/utils.cpython-37m-arm-linux-gnueabihf.so -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,108 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/writeExtractedCoordsAsPDB.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,111 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/computeDGGrid.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,114 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/prepareMSMFolders.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,116 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/checkDetailedBalance.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,119 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/computeDeltaG.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,122 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/__init__.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,124 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/calculateDGiterations.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,127 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/calculateAdaptiveDGiterations.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,130 copying build/lib.linux-armv7l-3.7/AdaptivePELE/freeEnergies/estimateDGAdaptive.py -> build/bdist.linux-armv7l/wheel/AdaptivePELE/freeEnergies 2021-05-14T13:04:03,132 running install_egg_info 2021-05-14T13:04:03,162 running egg_info 2021-05-14T13:04:03,163 writing AdaptivePELE.egg-info/PKG-INFO 2021-05-14T13:04:03,166 writing dependency_links to AdaptivePELE.egg-info/dependency_links.txt 2021-05-14T13:04:03,168 writing requirements to AdaptivePELE.egg-info/requires.txt 2021-05-14T13:04:03,170 writing top-level names to AdaptivePELE.egg-info/top_level.txt 2021-05-14T13:04:03,214 reading manifest file 'AdaptivePELE.egg-info/SOURCES.txt' 2021-05-14T13:04:03,223 reading manifest template 'MANIFEST.in' 2021-05-14T13:04:03,273 writing manifest file 'AdaptivePELE.egg-info/SOURCES.txt' 2021-05-14T13:04:03,276 Copying AdaptivePELE.egg-info to build/bdist.linux-armv7l/wheel/AdaptivePELE-1.7.1-py3.7.egg-info 2021-05-14T13:04:03,290 running install_scripts 2021-05-14T13:04:03,343 creating build/bdist.linux-armv7l/wheel/AdaptivePELE-1.7.1.dist-info/WHEEL 2021-05-14T13:04:03,346 creating '/tmp/pip-wheel-842el24b/AdaptivePELE-1.7.1-cp37-cp37m-linux_armv7l.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2021-05-14T13:04:03,349 adding 'AdaptivePELE/__init__.py' 2021-05-14T13:04:03,355 adding 'AdaptivePELE/adaptiveSampling.py' 2021-05-14T13:04:03,357 adding 'AdaptivePELE/automateRoundsAdaptive.py' 2021-05-14T13:04:03,359 adding 'AdaptivePELE/makeRelease.py' 2021-05-14T13:04:03,361 adding 'AdaptivePELE/runAllTests.py' 2021-05-14T13:04:03,364 adding 'AdaptivePELE/analysis/__init__.py' 2021-05-14T13:04:03,366 adding 'AdaptivePELE/analysis/addRejectedSteps.py' 2021-05-14T13:04:03,368 adding 'AdaptivePELE/analysis/analyse.py' 2021-05-14T13:04:03,370 adding 'AdaptivePELE/analysis/analyseClustering.py' 2021-05-14T13:04:03,372 adding 'AdaptivePELE/analysis/analysis_utils.py' 2021-05-14T13:04:03,374 adding 'AdaptivePELE/analysis/autoCorrelation.py' 2021-05-14T13:04:03,376 adding 'AdaptivePELE/analysis/backtrackAdaptiveTrajectory.py' 2021-05-14T13:04:03,379 adding 'AdaptivePELE/analysis/bestStructs.py' 2021-05-14T13:04:03,381 adding 'AdaptivePELE/analysis/calculateDistances.py' 2021-05-14T13:04:03,384 adding 'AdaptivePELE/analysis/calculateSASAvalues.py' 2021-05-14T13:04:03,386 adding 'AdaptivePELE/analysis/cluster.py' 2021-05-14T13:04:03,389 adding 'AdaptivePELE/analysis/clusterAdaptiveRun.py' 2021-05-14T13:04:03,391 adding 'AdaptivePELE/analysis/clusters_lagtime_grid.py' 2021-05-14T13:04:03,394 adding 'AdaptivePELE/analysis/compareClustering.py' 2021-05-14T13:04:03,395 adding 'AdaptivePELE/analysis/convertTrajectory.py' 2021-05-14T13:04:03,398 adding 'AdaptivePELE/analysis/correctRMSD.py' 2021-05-14T13:04:03,400 adding 'AdaptivePELE/analysis/count_clusters.py' 2021-05-14T13:04:03,402 adding 'AdaptivePELE/analysis/crossValidationClustering.py' 2021-05-14T13:04:03,404 adding 'AdaptivePELE/analysis/dehidratate_and_align.py' 2021-05-14T13:04:03,405 adding 'AdaptivePELE/analysis/extract_ligand_traj.py' 2021-05-14T13:04:03,407 adding 'AdaptivePELE/analysis/filter_by_radius.py' 2021-05-14T13:04:03,409 adding 'AdaptivePELE/analysis/findfirstbindingevent.py' 2021-05-14T13:04:03,411 adding 'AdaptivePELE/analysis/foldersFirstBindingEvent.py' 2021-05-14T13:04:03,412 adding 'AdaptivePELE/analysis/generateBox.py' 2021-05-14T13:04:03,414 adding 'AdaptivePELE/analysis/histCM.py' 2021-05-14T13:04:03,416 adding 'AdaptivePELE/analysis/identifyClusterSnapshot.py' 2021-05-14T13:04:03,419 adding 'AdaptivePELE/analysis/interactivePlot.py' 2021-05-14T13:04:03,421 adding 'AdaptivePELE/analysis/makePNGs.py' 2021-05-14T13:04:03,423 adding 'AdaptivePELE/analysis/networkCM.py' 2021-05-14T13:04:03,425 adding 'AdaptivePELE/analysis/numberOfClusters.py' 2021-05-14T13:04:03,426 adding 'AdaptivePELE/analysis/pathwayRMSD.py' 2021-05-14T13:04:03,428 adding 'AdaptivePELE/analysis/plot3DNetwork.py' 2021-05-14T13:04:03,430 adding 'AdaptivePELE/analysis/plotAdaptive.py' 2021-05-14T13:04:03,432 adding 'AdaptivePELE/analysis/plotRMSF.py' 2021-05-14T13:04:03,433 adding 'AdaptivePELE/analysis/plotSpawningClusters.py' 2021-05-14T13:04:03,435 adding 'AdaptivePELE/analysis/reportSimulation.py' 2021-05-14T13:04:03,437 adding 'AdaptivePELE/analysis/selectOnPlot.py' 2021-05-14T13:04:03,439 adding 'AdaptivePELE/analysis/simple_postprocessing.py' 2021-05-14T13:04:03,440 adding 'AdaptivePELE/analysis/simulationToCsv.py' 2021-05-14T13:04:03,441 adding 'AdaptivePELE/analysis/splitTrajectory.py' 2021-05-14T13:04:03,443 adding 'AdaptivePELE/analysis/standarize_MD_energies.py' 2021-05-14T13:04:03,445 adding 'AdaptivePELE/analysis/trajectory_processing.py' 2021-05-14T13:04:03,446 adding 'AdaptivePELE/analysis/unbinding.py' 2021-05-14T13:04:03,448 adding 'AdaptivePELE/analysis/writeClusteringStructures.py' 2021-05-14T13:04:03,449 adding 'AdaptivePELE/analysis/writeNetworkFiles.py' 2021-05-14T13:04:03,450 adding 'AdaptivePELE/analysis/writeTrajToSnapshot.py' 2021-05-14T13:04:03,539 adding 'AdaptivePELE/atomset/RMSDCalculator.cpython-37m-arm-linux-gnueabihf.so' 2021-05-14T13:04:03,678 adding 'AdaptivePELE/atomset/SymmetryContactMapEvaluator.cpython-37m-arm-linux-gnueabihf.so' 2021-05-14T13:04:03,684 adding 'AdaptivePELE/atomset/__init__.py' 2021-05-14T13:04:03,985 adding 'AdaptivePELE/atomset/atomset.cpython-37m-arm-linux-gnueabihf.so' 2021-05-14T13:04:03,997 adding 'AdaptivePELE/atomset/setup.py' 2021-05-14T13:04:03,999 adding 'AdaptivePELE/clustering/__init__.py' 2021-05-14T13:04:04,008 adding 'AdaptivePELE/clustering/clustering.py' 2021-05-14T13:04:04,010 adding 'AdaptivePELE/clustering/clusteringTypes.py' 2021-05-14T13:04:04,011 adding 'AdaptivePELE/clustering/thresholdcalculator.py' 2021-05-14T13:04:04,013 adding 'AdaptivePELE/clustering/thresholdcalculatortypes.py' 2021-05-14T13:04:04,015 adding 'AdaptivePELE/constants/__init__.py' 2021-05-14T13:04:04,016 adding 'AdaptivePELE/constants/blockNames.py' 2021-05-14T13:04:04,018 adding 'AdaptivePELE/constants/buildEnvironments.py' 2021-05-14T13:04:04,019 adding 'AdaptivePELE/constants/constants.py' 2021-05-14T13:04:04,021 adding 'AdaptivePELE/constants/symmetries.py' 2021-05-14T13:04:04,023 adding 'AdaptivePELE/freeEnergies/__init__.py' 2021-05-14T13:04:04,024 adding 'AdaptivePELE/freeEnergies/calculateAdaptiveDGiterations.py' 2021-05-14T13:04:04,026 adding 'AdaptivePELE/freeEnergies/calculateDGiterations.py' 2021-05-14T13:04:04,028 adding 'AdaptivePELE/freeEnergies/checkDetailedBalance.py' 2021-05-14T13:04:04,029 adding 'AdaptivePELE/freeEnergies/cluster.py' 2021-05-14T13:04:04,031 adding 'AdaptivePELE/freeEnergies/computeDGGrid.py' 2021-05-14T13:04:04,034 adding 'AdaptivePELE/freeEnergies/computeDeltaG.py' 2021-05-14T13:04:04,036 adding 'AdaptivePELE/freeEnergies/estimate.py' 2021-05-14T13:04:04,038 adding 'AdaptivePELE/freeEnergies/estimateDG.py' 2021-05-14T13:04:04,040 adding 'AdaptivePELE/freeEnergies/estimateDGAdaptive.py' 2021-05-14T13:04:04,042 adding 'AdaptivePELE/freeEnergies/extendTrajectories.py' 2021-05-14T13:04:04,046 adding 'AdaptivePELE/freeEnergies/extractCoords.py' 2021-05-14T13:04:04,048 adding 'AdaptivePELE/freeEnergies/getRepresentativeStructures.py' 2021-05-14T13:04:04,049 adding 'AdaptivePELE/freeEnergies/ownBuildMSM.py' 2021-05-14T13:04:04,051 adding 'AdaptivePELE/freeEnergies/prepareMSMFolders.py' 2021-05-14T13:04:04,053 adding 'AdaptivePELE/freeEnergies/runMarkovChainModel.py' 2021-05-14T13:04:04,054 adding 'AdaptivePELE/freeEnergies/utilitiesFreeEnergies.py' 2021-05-14T13:04:04,243 adding 'AdaptivePELE/freeEnergies/utils.cpython-37m-arm-linux-gnueabihf.so' 2021-05-14T13:04:04,250 adding 'AdaptivePELE/freeEnergies/writeExtractedCoordsAsPDB.py' 2021-05-14T13:04:04,252 adding 'AdaptivePELE/simulation/__init__.py' 2021-05-14T13:04:04,257 adding 'AdaptivePELE/simulation/openmm_simulations.py' 2021-05-14T13:04:04,259 adding 'AdaptivePELE/simulation/simulationTypes.py' 2021-05-14T13:04:04,267 adding 'AdaptivePELE/simulation/simulationrunner.py' 2021-05-14T13:04:04,270 adding 'AdaptivePELE/spawning/__init__.py' 2021-05-14T13:04:04,272 adding 'AdaptivePELE/spawning/densitycalculator.py' 2021-05-14T13:04:04,273 adding 'AdaptivePELE/spawning/densitycalculatortypes.py' 2021-05-14T13:04:04,279 adding 'AdaptivePELE/spawning/spawning.py' 2021-05-14T13:04:04,281 adding 'AdaptivePELE/spawning/spawningTypes.py' 2021-05-14T13:04:04,283 adding 'AdaptivePELE/tests/__init__.py' 2021-05-14T13:04:04,285 adding 'AdaptivePELE/tests/testAdaptiveSampling.py' 2021-05-14T13:04:04,288 adding 'AdaptivePELE/tests/testAtomset.py' 2021-05-14T13:04:04,289 adding 'AdaptivePELE/tests/testClustering.py' 2021-05-14T13:04:04,291 adding 'AdaptivePELE/tests/testDensityCalculator.py' 2021-05-14T13:04:04,292 adding 'AdaptivePELE/tests/testMD.py' 2021-05-14T13:04:04,293 adding 'AdaptivePELE/tests/testMD_CUDA.py' 2021-05-14T13:04:04,295 adding 'AdaptivePELE/tests/testReporter.py' 2021-05-14T13:04:04,297 adding 'AdaptivePELE/tests/testSpawning.py' 2021-05-14T13:04:04,298 adding 'AdaptivePELE/tests/testThresholdcalculator.py' 2021-05-14T13:04:04,303 adding 'AdaptivePELE/utilities/PDBLoader.py' 2021-05-14T13:04:04,305 adding 'AdaptivePELE/utilities/__init__.py' 2021-05-14T13:04:04,306 adding 'AdaptivePELE/utilities/clusteringUtilities.py' 2021-05-14T13:04:04,308 adding 'AdaptivePELE/utilities/conda_deployment.py' 2021-05-14T13:04:04,309 adding 'AdaptivePELE/utilities/generate_topology_object.py' 2021-05-14T13:04:04,311 adding 'AdaptivePELE/utilities/synchronization.py' 2021-05-14T13:04:04,316 adding 'AdaptivePELE/utilities/utilities.py' 2021-05-14T13:04:04,318 adding 'AdaptivePELE/validator/__init__.py' 2021-05-14T13:04:04,320 adding 'AdaptivePELE/validator/controlFileValidator.py' 2021-05-14T13:04:04,322 adding 'AdaptivePELE/validator/validatorBlockNames.py' 2021-05-14T13:04:04,324 adding 'AdaptivePELE-1.7.1.dist-info/METADATA' 2021-05-14T13:04:04,325 adding 'AdaptivePELE-1.7.1.dist-info/WHEEL' 2021-05-14T13:04:04,326 adding 'AdaptivePELE-1.7.1.dist-info/top_level.txt' 2021-05-14T13:04:04,328 adding 'AdaptivePELE-1.7.1.dist-info/RECORD' 2021-05-14T13:04:04,352 removing build/bdist.linux-armv7l/wheel 2021-05-14T13:04:04,694 Building wheel for adaptivepele (setup.py): finished with status 'done' 2021-05-14T13:04:04,719 Created wheel for adaptivepele: filename=AdaptivePELE-1.7.1-cp37-cp37m-linux_armv7l.whl size=1616025 sha256=3292b60b31353aeff2e1832f504c186c202729cba0948d5ed44a194fab7eb63d 2021-05-14T13:04:04,719 Stored in directory: /tmp/pip-ephem-wheel-cache-b7ayjpce/wheels/a6/22/08/ba17ebbbb30f832bfe9307a9e50e26fc5f6a53bc03f7d337a4 2021-05-14T13:04:04,735 Successfully built adaptivepele 2021-05-14T13:04:04,794 Removed build tracker: '/tmp/pip-req-tracker-37lkp5c2'