2020-12-16T17:34:33,293 Created temporary directory: /tmp/pip-ephem-wheel-cache-yj05wvac 2020-12-16T17:34:33,296 Created temporary directory: /tmp/pip-req-tracker-_8y5gnt8 2020-12-16T17:34:33,296 Initialized build tracking at /tmp/pip-req-tracker-_8y5gnt8 2020-12-16T17:34:33,296 Created build tracker: /tmp/pip-req-tracker-_8y5gnt8 2020-12-16T17:34:33,297 Entered build tracker: /tmp/pip-req-tracker-_8y5gnt8 2020-12-16T17:34:33,297 Created temporary directory: /tmp/pip-wheel-u7wi1oj4 2020-12-16T17:34:33,307 1 location(s) to search for versions of acellera-htmd: 2020-12-16T17:34:33,307 * https://pypi.org/simple/acellera-htmd/ 2020-12-16T17:34:33,307 Fetching project page and analyzing links: https://pypi.org/simple/acellera-htmd/ 2020-12-16T17:34:33,308 Getting page https://pypi.org/simple/acellera-htmd/ 2020-12-16T17:34:33,309 Found index url https://pypi.org/simple 2020-12-16T17:34:33,667 Found link https://files.pythonhosted.org/packages/7b/b5/296a5fe7573797fca6eb9e1820feaceb3e078cbd4905156960e9ba779fac/acellera-htmd-1.23.2.tar.gz#sha256=82412123b08dae2961ba4da131942e4f92be7d13ee24cc8ec4f092ef4b022d6f (from https://pypi.org/simple/acellera-htmd/), version: 1.23.2 2020-12-16T17:34:33,667 Found link https://files.pythonhosted.org/packages/63/8e/389b32ca6a0789b30ad1483dbfeeb46916450ba1a1f6c953966e9903bbbb/acellera-htmd-1.23.4.tar.gz#sha256=827b5f6ef861b48609d20cd5d7a5d8df29f55b4d58fdb9f307a66361f43cb3d7 (from https://pypi.org/simple/acellera-htmd/), version: 1.23.4 2020-12-16T17:34:33,668 Found link https://files.pythonhosted.org/packages/5d/56/5d7e8d3d4f979cd97a540bedf4c4edc7268388c9eb450bc4af0ce0084f1f/acellera-htmd-1.23.5.tar.gz#sha256=4144d5a6ac1ff10592115de152f7c5561a1b7f1b9056cc7c911bdd2b7ea06a62 (from https://pypi.org/simple/acellera-htmd/), version: 1.23.5 2020-12-16T17:34:33,668 Found link https://files.pythonhosted.org/packages/f2/ef/f3b5c44015b5e51757d54f7d27c4208a618f609036e8517b083034dc1ada/acellera-htmd-1.23.6.tar.gz#sha256=dd0a5442ab87c97c06f5674cd3867856c0215f89d5244611035e68db6b32cfed (from https://pypi.org/simple/acellera-htmd/), version: 1.23.6 2020-12-16T17:34:33,672 Given no hashes to check 1 links for project 'acellera-htmd': discarding no candidates 2020-12-16T17:34:33,673 Using version 1.23.6 (newest of versions: 1.23.6) 2020-12-16T17:34:33,676 Collecting acellera-htmd==1.23.6 2020-12-16T17:34:33,678 Created temporary directory: /tmp/pip-unpack-j1uh0_fu 2020-12-16T17:34:33,724 Downloading acellera-htmd-1.23.6.tar.gz (851 kB) 2020-12-16T17:34:34,728 Added acellera-htmd==1.23.6 from https://files.pythonhosted.org/packages/f2/ef/f3b5c44015b5e51757d54f7d27c4208a618f609036e8517b083034dc1ada/acellera-htmd-1.23.6.tar.gz#sha256=dd0a5442ab87c97c06f5674cd3867856c0215f89d5244611035e68db6b32cfed to build tracker '/tmp/pip-req-tracker-_8y5gnt8' 2020-12-16T17:34:34,729 Running setup.py (path:/tmp/pip-wheel-u7wi1oj4/acellera-htmd/setup.py) egg_info for package acellera-htmd 2020-12-16T17:34:34,730 Created temporary directory: /tmp/pip-pip-egg-info-mvrv8qcq 2020-12-16T17:34:34,731 Running command python setup.py egg_info 2020-12-16T17:34:35,554 fatal: not a git repository (or any of the parent directories): .git 2020-12-16T17:34:35,766 Could not get version tag. Defaulting to version 0 2020-12-16T17:34:35,766 running egg_info 2020-12-16T17:34:35,768 creating /tmp/pip-pip-egg-info-mvrv8qcq/acellera_htmd.egg-info 2020-12-16T17:34:35,770 writing /tmp/pip-pip-egg-info-mvrv8qcq/acellera_htmd.egg-info/PKG-INFO 2020-12-16T17:34:35,773 writing dependency_links to /tmp/pip-pip-egg-info-mvrv8qcq/acellera_htmd.egg-info/dependency_links.txt 2020-12-16T17:34:35,775 writing entry points to /tmp/pip-pip-egg-info-mvrv8qcq/acellera_htmd.egg-info/entry_points.txt 2020-12-16T17:34:35,777 writing requirements to /tmp/pip-pip-egg-info-mvrv8qcq/acellera_htmd.egg-info/requires.txt 2020-12-16T17:34:35,778 writing top-level names to /tmp/pip-pip-egg-info-mvrv8qcq/acellera_htmd.egg-info/top_level.txt 2020-12-16T17:34:35,780 writing manifest file '/tmp/pip-pip-egg-info-mvrv8qcq/acellera_htmd.egg-info/SOURCES.txt' 2020-12-16T17:34:35,959 reading manifest file '/tmp/pip-pip-egg-info-mvrv8qcq/acellera_htmd.egg-info/SOURCES.txt' 2020-12-16T17:34:35,962 reading manifest template 'MANIFEST.in' 2020-12-16T17:34:35,964 warning: no previously-included files matching '*' found under directory 'htmd/data' 2020-12-16T17:34:35,964 warning: no previously-included files matching '*' found under directory 'data' 2020-12-16T17:34:35,965 warning: no files found matching 'HTMD_LICENSE.txt' 2020-12-16T17:34:35,977 writing manifest file '/tmp/pip-pip-egg-info-mvrv8qcq/acellera_htmd.egg-info/SOURCES.txt' 2020-12-16T17:34:36,041 WARNING: Requested acellera-htmd==1.23.6 from https://files.pythonhosted.org/packages/f2/ef/f3b5c44015b5e51757d54f7d27c4208a618f609036e8517b083034dc1ada/acellera-htmd-1.23.6.tar.gz#sha256=dd0a5442ab87c97c06f5674cd3867856c0215f89d5244611035e68db6b32cfed, but installing version 0 2020-12-16T17:34:36,042 Removed acellera-htmd==1.23.6 from https://files.pythonhosted.org/packages/f2/ef/f3b5c44015b5e51757d54f7d27c4208a618f609036e8517b083034dc1ada/acellera-htmd-1.23.6.tar.gz#sha256=dd0a5442ab87c97c06f5674cd3867856c0215f89d5244611035e68db6b32cfed from build tracker '/tmp/pip-req-tracker-_8y5gnt8' 2020-12-16T17:34:36,044 Building wheels for collected packages: acellera-htmd 2020-12-16T17:34:36,049 Created temporary directory: /tmp/pip-wheel-63fhyo8u 2020-12-16T17:34:36,050 Building wheel for acellera-htmd (setup.py): started 2020-12-16T17:34:36,050 Destination directory: /tmp/pip-wheel-63fhyo8u 2020-12-16T17:34:36,050 Running command /usr/bin/python3 -u -c 'import sys, setuptools, tokenize; sys.argv[0] = '"'"'/tmp/pip-wheel-u7wi1oj4/acellera-htmd/setup.py'"'"'; __file__='"'"'/tmp/pip-wheel-u7wi1oj4/acellera-htmd/setup.py'"'"';f=getattr(tokenize, '"'"'open'"'"', open)(__file__);code=f.read().replace('"'"'\r\n'"'"', '"'"'\n'"'"');f.close();exec(compile(code, __file__, '"'"'exec'"'"'))' bdist_wheel -d /tmp/pip-wheel-63fhyo8u 2020-12-16T17:34:36,878 fatal: not a git repository (or any of the parent directories): .git 2020-12-16T17:34:36,879 Could not get version tag. Defaulting to version 0 2020-12-16T17:34:37,085 running bdist_wheel 2020-12-16T17:34:37,092 running build 2020-12-16T17:34:37,093 running build_py 2020-12-16T17:34:37,223 creating build 2020-12-16T17:34:37,224 creating build/lib 2020-12-16T17:34:37,224 creating build/lib/htmdx 2020-12-16T17:34:37,225 copying htmdx/__init__.py -> build/lib/htmdx 2020-12-16T17:34:37,227 copying htmdx/license.py -> build/lib/htmdx 2020-12-16T17:34:37,229 copying htmdx/cli.py -> build/lib/htmdx 2020-12-16T17:34:37,233 creating build/lib/htmd 2020-12-16T17:34:37,234 copying htmd/__init__.py -> build/lib/htmd 2020-12-16T17:34:37,237 copying htmd/versionwarnings.py -> build/lib/htmd 2020-12-16T17:34:37,240 copying htmd/numbautil.py -> build/lib/htmd 2020-12-16T17:34:37,242 copying htmd/latest.py -> build/lib/htmd 2020-12-16T17:34:37,245 copying htmd/modelhmm.py -> build/lib/htmd 2020-12-16T17:34:37,248 copying htmd/parallelprogress.py -> build/lib/htmd 2020-12-16T17:34:37,250 copying htmd/units.py -> build/lib/htmd 2020-12-16T17:34:37,253 copying htmd/config.py -> build/lib/htmd 2020-12-16T17:34:37,256 copying htmd/version.py -> build/lib/htmd 2020-12-16T17:34:37,258 copying htmd/kineticshmm.py -> build/lib/htmd 2020-12-16T17:34:37,261 copying htmd/ui.py -> build/lib/htmd 2020-12-16T17:34:37,264 copying htmd/util.py -> build/lib/htmd 2020-12-16T17:34:37,267 copying htmd/kinetics.py -> build/lib/htmd 2020-12-16T17:34:37,270 copying htmd/decorators.py -> build/lib/htmd 2020-12-16T17:34:37,273 copying htmd/pathplanning.py -> build/lib/htmd 2020-12-16T17:34:37,276 copying htmd/simlist.py -> build/lib/htmd 2020-12-16T17:34:37,279 copying htmd/dock.py -> build/lib/htmd 2020-12-16T17:34:37,282 copying htmd/mutualinformation.py -> build/lib/htmd 2020-12-16T17:34:37,284 copying htmd/metricdata.py -> build/lib/htmd 2020-12-16T17:34:37,289 copying htmd/session.py -> build/lib/htmd 2020-12-16T17:34:37,291 copying htmd/home.py -> build/lib/htmd 2020-12-16T17:34:37,294 copying htmd/model.py -> build/lib/htmd 2020-12-16T17:34:37,299 creating build/lib/htmd/membranebuilder 2020-12-16T17:34:37,300 copying htmd/membranebuilder/__init__.py -> build/lib/htmd/membranebuilder 2020-12-16T17:34:37,303 copying htmd/membranebuilder/ringpenetration.py -> build/lib/htmd/membranebuilder 2020-12-16T17:34:37,306 copying htmd/membranebuilder/build_membrane.py -> build/lib/htmd/membranebuilder 2020-12-16T17:34:37,308 copying htmd/membranebuilder/pdbreporter.py -> build/lib/htmd/membranebuilder 2020-12-16T17:34:37,311 copying htmd/membranebuilder/ljfluid.py -> build/lib/htmd/membranebuilder 2020-12-16T17:34:37,314 copying htmd/membranebuilder/globalminimization.py -> build/lib/htmd/membranebuilder 2020-12-16T17:34:37,316 copying htmd/membranebuilder/simulate_openmm.py -> build/lib/htmd/membranebuilder 2020-12-16T17:34:37,320 creating build/lib/htmd/projections 2020-12-16T17:34:37,321 copying htmd/projections/tica.py -> build/lib/htmd/projections 2020-12-16T17:34:37,324 copying htmd/projections/__init__.py -> build/lib/htmd/projections 2020-12-16T17:34:37,326 copying htmd/projections/metriccoordinate.py -> build/lib/htmd/projections 2020-12-16T17:34:37,328 copying htmd/projections/kmeanstri.py -> build/lib/htmd/projections 2020-12-16T17:34:37,330 copying htmd/projections/metrictmscore.py -> build/lib/htmd/projections 2020-12-16T17:34:37,332 copying htmd/projections/metricsecondarystructure.py -> build/lib/htmd/projections 2020-12-16T17:34:37,335 copying htmd/projections/metricplumed2.py -> build/lib/htmd/projections 2020-12-16T17:34:37,337 copying htmd/projections/metricsasa.py -> build/lib/htmd/projections 2020-12-16T17:34:37,339 copying htmd/projections/metricdistance.py -> build/lib/htmd/projections 2020-12-16T17:34:37,341 copying htmd/projections/metricsphericalcoordinate.py -> build/lib/htmd/projections 2020-12-16T17:34:37,343 copying htmd/projections/metricrmsd.py -> build/lib/htmd/projections 2020-12-16T17:34:37,346 copying htmd/projections/metric.py -> build/lib/htmd/projections 2020-12-16T17:34:37,348 copying htmd/projections/gwpca.py -> build/lib/htmd/projections 2020-12-16T17:34:37,350 copying htmd/projections/metricdihedral.py -> build/lib/htmd/projections 2020-12-16T17:34:37,353 copying htmd/projections/metricfluctuation.py -> build/lib/htmd/projections 2020-12-16T17:34:37,355 copying htmd/projections/metricshell.py -> build/lib/htmd/projections 2020-12-16T17:34:37,358 creating build/lib/htmd/builder 2020-12-16T17:34:37,359 copying htmd/builder/loopmodeler.py -> build/lib/htmd/builder 2020-12-16T17:34:37,362 copying htmd/builder/__init__.py -> build/lib/htmd/builder 2020-12-16T17:34:37,363 copying htmd/builder/preparation.py -> build/lib/htmd/builder 2020-12-16T17:34:37,366 copying htmd/builder/charmm.py -> build/lib/htmd/builder 2020-12-16T17:34:37,369 copying htmd/builder/builder.py -> build/lib/htmd/builder 2020-12-16T17:34:37,372 copying htmd/builder/solvate.py -> build/lib/htmd/builder 2020-12-16T17:34:37,374 copying htmd/builder/ionize.py -> build/lib/htmd/builder 2020-12-16T17:34:37,377 copying htmd/builder/amber.py -> build/lib/htmd/builder 2020-12-16T17:34:37,381 creating build/lib/htmd/apps 2020-12-16T17:34:37,382 copying htmd/apps/__init__.py -> build/lib/htmd/apps 2020-12-16T17:34:37,384 copying htmd/apps/pmemd.py -> build/lib/htmd/apps 2020-12-16T17:34:37,388 copying htmd/apps/acemd.py -> build/lib/htmd/apps 2020-12-16T17:34:37,392 creating build/lib/htmd/protocols 2020-12-16T17:34:37,393 copying htmd/protocols/__init__.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,395 copying htmd/protocols/production_v4.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,398 copying htmd/protocols/equilibration_v3.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,401 copying htmd/protocols/pmemdproduction.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,404 copying htmd/protocols/equilibration_v1.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,408 copying htmd/protocols/production_v2.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,411 copying htmd/protocols/production_v3.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,414 copying htmd/protocols/oldprotocolinterface.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,417 copying htmd/protocols/production_v5.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,420 copying htmd/protocols/equilibration_v2.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,423 copying htmd/protocols/production_v6.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,426 copying htmd/protocols/production_v1.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,428 copying htmd/protocols/pmemdequilibration.py -> build/lib/htmd/protocols 2020-12-16T17:34:37,432 creating build/lib/htmd/molecule 2020-12-16T17:34:37,433 copying htmd/molecule/__init__.py -> build/lib/htmd/molecule 2020-12-16T17:34:37,435 copying htmd/molecule/molecule.py -> build/lib/htmd/molecule 2020-12-16T17:34:37,437 copying htmd/molecule/util.py -> build/lib/htmd/molecule 2020-12-16T17:34:37,440 creating build/lib/htmd/mdengine 2020-12-16T17:34:37,441 copying htmd/mdengine/__init__.py -> build/lib/htmd/mdengine 2020-12-16T17:34:37,443 creating build/lib/htmd/clustering 2020-12-16T17:34:37,444 copying htmd/clustering/__init__.py -> build/lib/htmd/clustering 2020-12-16T17:34:37,446 copying htmd/clustering/kcenters.py -> build/lib/htmd/clustering 2020-12-16T17:34:37,449 copying htmd/clustering/regular.py -> build/lib/htmd/clustering 2020-12-16T17:34:37,452 creating build/lib/htmd/adaptive 2020-12-16T17:34:37,453 copying htmd/adaptive/__init__.py -> build/lib/htmd/adaptive 2020-12-16T17:34:37,455 copying htmd/adaptive/adaptiverun.py -> build/lib/htmd/adaptive 2020-12-16T17:34:37,458 copying htmd/adaptive/adaptivegoal.py -> build/lib/htmd/adaptive 2020-12-16T17:34:37,461 copying htmd/adaptive/adaptivebandit.py -> build/lib/htmd/adaptive 2020-12-16T17:34:37,464 copying htmd/adaptive/adaptive.py -> build/lib/htmd/adaptive 2020-12-16T17:34:37,467 copying htmd/adaptive/util.py -> build/lib/htmd/adaptive 2020-12-16T17:34:37,469 copying htmd/adaptive/adaptivegoaleg.py -> build/lib/htmd/adaptive 2020-12-16T17:34:37,473 creating build/lib/htmd/queues 2020-12-16T17:34:37,474 copying htmd/queues/__init__.py -> build/lib/htmd/queues 2020-12-16T17:34:37,476 copying htmd/queues/slurmqueue.py -> build/lib/htmd/queues 2020-12-16T17:34:37,478 copying htmd/queues/simqueue.py -> build/lib/htmd/queues 2020-12-16T17:34:37,480 copying htmd/queues/pbsqueue.py -> build/lib/htmd/queues 2020-12-16T17:34:37,482 copying htmd/queues/lsfqueue.py -> build/lib/htmd/queues 2020-12-16T17:34:37,485 copying htmd/queues/playqueue.py -> build/lib/htmd/queues 2020-12-16T17:34:37,487 copying htmd/queues/localqueue.py -> build/lib/htmd/queues 2020-12-16T17:34:37,490 creating build/lib/htmd/mdengine/acemd 2020-12-16T17:34:37,491 copying htmd/mdengine/acemd/__init__.py -> build/lib/htmd/mdengine/acemd 2020-12-16T17:34:37,493 copying htmd/mdengine/acemd/acemd.py -> build/lib/htmd/mdengine/acemd 2020-12-16T17:34:37,521 creating build/lib/htmd/share 2020-12-16T17:34:37,522 creating build/lib/htmd/share/membranebuilder 2020-12-16T17:34:37,522 creating build/lib/htmd/share/membranebuilder/lipids 2020-12-16T17:34:37,523 creating build/lib/htmd/share/membranebuilder/lipids/pope 2020-12-16T17:34:37,525 copying htmd/share/membranebuilder/lipids/pope/pope.pdb -> build/lib/htmd/share/membranebuilder/lipids/pope 2020-12-16T17:34:37,528 creating build/lib/htmd/share/membranebuilder/lipids/chl1 2020-12-16T17:34:37,529 copying htmd/share/membranebuilder/lipids/chl1/chl1.pdb -> build/lib/htmd/share/membranebuilder/lipids/chl1 2020-12-16T17:34:37,532 creating build/lib/htmd/share/membranebuilder/lipids/popc 2020-12-16T17:34:37,533 copying htmd/share/membranebuilder/lipids/popc/popc.pdb -> build/lib/htmd/share/membranebuilder/lipids/popc 2020-12-16T17:34:37,536 creating build/lib/htmd/share/builder 2020-12-16T17:34:37,536 creating build/lib/htmd/share/builder/charmmfiles 2020-12-16T17:34:37,537 creating build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,538 copying htmd/share/builder/charmmfiles/par/par_all22star_prot.prm -> build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,546 copying htmd/share/builder/charmmfiles/par/par_all35_ethers.prm -> build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,550 copying htmd/share/builder/charmmfiles/par/par_all22_prot.prm -> build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,558 copying htmd/share/builder/charmmfiles/par/par_all36_lipid.prm -> build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,561 copying htmd/share/builder/charmmfiles/par/par_all36_na.prm -> build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,566 copying htmd/share/builder/charmmfiles/par/par_all36_prot.prm -> build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,573 copying htmd/share/builder/charmmfiles/par/par_all36m_prot.prm -> build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,581 copying htmd/share/builder/charmmfiles/par/par_all36_cgenff.prm -> build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,601 copying htmd/share/builder/charmmfiles/par/par_all36_carb.prm -> build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,608 copying htmd/share/builder/charmmfiles/par/par_water_ions.prm -> build/lib/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:37,611 creating build/lib/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:37,612 copying htmd/share/builder/charmmfiles/top/top_all36_carb.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:37,626 copying htmd/share/builder/charmmfiles/top/top_all35_ethers.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:37,631 copying htmd/share/builder/charmmfiles/top/top_all36_na.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:37,636 copying htmd/share/builder/charmmfiles/top/top_all22_prot.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:37,641 copying htmd/share/builder/charmmfiles/top/top_water_ions.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:37,644 copying htmd/share/builder/charmmfiles/top/top_all36_lipid.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:37,663 copying htmd/share/builder/charmmfiles/top/top_all22star_prot.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:37,668 copying htmd/share/builder/charmmfiles/top/top_all36_prot.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:37,673 copying htmd/share/builder/charmmfiles/top/top_all36_cgenff.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:37,735 creating build/lib/htmd/share/builder/amberfiles 2020-12-16T17:34:37,736 creating build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,737 copying htmd/share/builder/amberfiles/ff-ncaa/HLX.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,740 copying htmd/share/builder/amberfiles/ff-ncaa/MLZ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,742 copying htmd/share/builder/amberfiles/ff-ncaa/MMO.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,745 copying htmd/share/builder/amberfiles/ff-ncaa/ALC.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,747 copying htmd/share/builder/amberfiles/ff-ncaa/TRO.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,750 copying htmd/share/builder/amberfiles/ff-ncaa/NVA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,753 copying htmd/share/builder/amberfiles/ff-ncaa/LME.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,756 copying htmd/share/builder/amberfiles/ff-ncaa/2AS.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,759 copying htmd/share/builder/amberfiles/ff-ncaa/AA4.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,762 copying htmd/share/builder/amberfiles/ff-ncaa/IGL.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,765 copying htmd/share/builder/amberfiles/ff-ncaa/NLE.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,768 copying htmd/share/builder/amberfiles/ff-ncaa/ffncaa.in -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,776 copying htmd/share/builder/amberfiles/ff-ncaa/OCY.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,780 copying htmd/share/builder/amberfiles/ff-ncaa/TY2.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,783 copying htmd/share/builder/amberfiles/ff-ncaa/YCM.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,786 copying htmd/share/builder/amberfiles/ff-ncaa/2ML.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,790 copying htmd/share/builder/amberfiles/ff-ncaa/HQA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,793 copying htmd/share/builder/amberfiles/ff-ncaa/README.txt -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,796 copying htmd/share/builder/amberfiles/ff-ncaa/YNM.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,800 copying htmd/share/builder/amberfiles/ff-ncaa/4PH.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,803 copying htmd/share/builder/amberfiles/ff-ncaa/OMX.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,807 copying htmd/share/builder/amberfiles/ff-ncaa/004.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,810 copying htmd/share/builder/amberfiles/ff-ncaa/GHG.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,814 copying htmd/share/builder/amberfiles/ff-ncaa/0BN.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,817 copying htmd/share/builder/amberfiles/ff-ncaa/HPE.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,820 copying htmd/share/builder/amberfiles/ff-ncaa/DPP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,822 copying htmd/share/builder/amberfiles/ff-ncaa/5JP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,825 copying htmd/share/builder/amberfiles/ff-ncaa/I2M.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,828 copying htmd/share/builder/amberfiles/ff-ncaa/0A1.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,830 copying htmd/share/builder/amberfiles/ff-ncaa/D4P.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,833 copying htmd/share/builder/amberfiles/ff-ncaa/FGL.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,836 copying htmd/share/builder/amberfiles/ff-ncaa/ONL.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,838 copying htmd/share/builder/amberfiles/ff-ncaa/DAB.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,841 copying htmd/share/builder/amberfiles/ff-ncaa/ME0.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,844 copying htmd/share/builder/amberfiles/ff-ncaa/1MH.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,846 copying htmd/share/builder/amberfiles/ff-ncaa/2GX.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,849 copying htmd/share/builder/amberfiles/ff-ncaa/MLE.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,851 copying htmd/share/builder/amberfiles/ff-ncaa/LMQ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,854 copying htmd/share/builder/amberfiles/ff-ncaa/ABA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,856 copying htmd/share/builder/amberfiles/ff-ncaa/HHK.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,859 copying htmd/share/builder/amberfiles/ff-ncaa/MME.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,861 copying htmd/share/builder/amberfiles/ff-ncaa/HOX.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,864 copying htmd/share/builder/amberfiles/ff-ncaa/MEN.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,866 copying htmd/share/builder/amberfiles/ff-ncaa/NZC.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,869 copying htmd/share/builder/amberfiles/ff-ncaa/CCS.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,871 copying htmd/share/builder/amberfiles/ff-ncaa/ESC.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,874 copying htmd/share/builder/amberfiles/ff-ncaa/4IN.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,876 copying htmd/share/builder/amberfiles/ff-ncaa/MEQ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,879 copying htmd/share/builder/amberfiles/ff-ncaa/IIL.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,881 copying htmd/share/builder/amberfiles/ff-ncaa/BCS.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,884 copying htmd/share/builder/amberfiles/ff-ncaa/NAL.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,886 copying htmd/share/builder/amberfiles/ff-ncaa/TYQ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,889 copying htmd/share/builder/amberfiles/ff-ncaa/MVA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,891 copying htmd/share/builder/amberfiles/ff-ncaa/KYN.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,893 copying htmd/share/builder/amberfiles/ff-ncaa/HTR.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,896 copying htmd/share/builder/amberfiles/ff-ncaa/HLU.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,898 copying htmd/share/builder/amberfiles/ff-ncaa/CSA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,901 copying htmd/share/builder/amberfiles/ff-ncaa/APD.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,903 copying htmd/share/builder/amberfiles/ff-ncaa/03Y.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,906 copying htmd/share/builder/amberfiles/ff-ncaa/MEA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,908 copying htmd/share/builder/amberfiles/ff-ncaa/NCY.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,911 copying htmd/share/builder/amberfiles/ff-ncaa/AHP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,913 copying htmd/share/builder/amberfiles/ff-ncaa/GNC.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,916 copying htmd/share/builder/amberfiles/ff-ncaa/IML.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,918 copying htmd/share/builder/amberfiles/ff-ncaa/GME.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,921 copying htmd/share/builder/amberfiles/ff-ncaa/ALN.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,923 copying htmd/share/builder/amberfiles/ff-ncaa/BB8.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:37,926 creating build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:37,927 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/ff-nucleic-OL15.lib -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:37,932 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/README.txt -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:37,934 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/leap-ff-nucleic-OL15.in -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:37,937 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/leap.log -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:37,940 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/leaprc.ff-nucleic-OL15 -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:37,942 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/ff-nucleic-OL15.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:37,945 creating build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,946 copying htmd/share/builder/amberfiles/ff-ptm/CSP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,949 copying htmd/share/builder/amberfiles/ff-ptm/HYP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,951 copying htmd/share/builder/amberfiles/ff-ptm/PRK.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,958 copying htmd/share/builder/amberfiles/ff-ptm/CGU.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,958 copying htmd/share/builder/amberfiles/ff-ptm/PTR.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,959 copying htmd/share/builder/amberfiles/ff-ptm/4PQ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,962 copying htmd/share/builder/amberfiles/ff-ptm/DAH.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,965 copying htmd/share/builder/amberfiles/ff-ptm/SEP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,967 copying htmd/share/builder/amberfiles/ff-ptm/2MR.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,970 copying htmd/share/builder/amberfiles/ff-ptm/P1L.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,972 copying htmd/share/builder/amberfiles/ff-ptm/BTK.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,975 copying htmd/share/builder/amberfiles/ff-ptm/README.txt -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,977 copying htmd/share/builder/amberfiles/ff-ptm/M3L.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,980 copying htmd/share/builder/amberfiles/ff-ptm/HY3.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,982 copying htmd/share/builder/amberfiles/ff-ptm/LYZ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,985 copying htmd/share/builder/amberfiles/ff-ptm/0AF.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,987 copying htmd/share/builder/amberfiles/ff-ptm/ORM.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,989 copying htmd/share/builder/amberfiles/ff-ptm/ALY.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,992 copying htmd/share/builder/amberfiles/ff-ptm/CSO.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,994 copying htmd/share/builder/amberfiles/ff-ptm/CSS.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,997 copying htmd/share/builder/amberfiles/ff-ptm/MLY.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:37,999 copying htmd/share/builder/amberfiles/ff-ptm/TPO.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,002 copying htmd/share/builder/amberfiles/ff-ptm/ffptm.in -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,006 copying htmd/share/builder/amberfiles/ff-ptm/PCA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,009 copying htmd/share/builder/amberfiles/ff-ptm/DA2.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,011 creating build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,012 copying htmd/share/builder/amberfiles/cofactors/HEM.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,015 copying htmd/share/builder/amberfiles/cofactors/NAD.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,017 copying htmd/share/builder/amberfiles/cofactors/ADP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,020 copying htmd/share/builder/amberfiles/cofactors/ATP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,022 copying htmd/share/builder/amberfiles/cofactors/README.txt -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,025 copying htmd/share/builder/amberfiles/cofactors/NAI.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,027 copying htmd/share/builder/amberfiles/cofactors/AMP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,030 copying htmd/share/builder/amberfiles/cofactors/GDP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,032 copying htmd/share/builder/amberfiles/cofactors/GTP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,035 copying htmd/share/builder/amberfiles/cofactors/NAP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,038 copying htmd/share/builder/amberfiles/cofactors/cofactors.in -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,042 copying htmd/share/builder/amberfiles/cofactors/FMN.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,044 creating build/lib/htmd/share/mdengine 2020-12-16T17:34:38,045 creating build/lib/htmd/share/mdengine/acemd 2020-12-16T17:34:38,045 creating build/lib/htmd/share/mdengine/acemd/config 2020-12-16T17:34:38,047 copying htmd/share/mdengine/acemd/config/production.json -> build/lib/htmd/share/mdengine/acemd/config 2020-12-16T17:34:38,049 copying htmd/share/mdengine/acemd/config/equilibration.json -> build/lib/htmd/share/mdengine/acemd/config 2020-12-16T17:34:38,052 copying htmd/logging.ini -> build/lib/htmd 2020-12-16T17:34:38,071 installing to build/bdist.linux-armv7l/wheel 2020-12-16T17:34:38,071 running install 2020-12-16T17:34:38,072 running install_lib 2020-12-16T17:34:38,077 creating build/bdist.linux-armv7l 2020-12-16T17:34:38,077 creating build/bdist.linux-armv7l/wheel 2020-12-16T17:34:38,079 creating build/bdist.linux-armv7l/wheel/htmdx 2020-12-16T17:34:38,080 copying build/lib/htmdx/__init__.py -> build/bdist.linux-armv7l/wheel/htmdx 2020-12-16T17:34:38,082 copying build/lib/htmdx/license.py -> build/bdist.linux-armv7l/wheel/htmdx 2020-12-16T17:34:38,084 copying build/lib/htmdx/cli.py -> build/bdist.linux-armv7l/wheel/htmdx 2020-12-16T17:34:38,087 creating build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,088 copying build/lib/htmd/__init__.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,090 copying build/lib/htmd/versionwarnings.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,093 copying build/lib/htmd/numbautil.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,095 copying build/lib/htmd/latest.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,097 copying build/lib/htmd/modelhmm.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,100 creating build/bdist.linux-armv7l/wheel/htmd/membranebuilder 2020-12-16T17:34:38,101 copying build/lib/htmd/membranebuilder/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/membranebuilder 2020-12-16T17:34:38,103 copying build/lib/htmd/membranebuilder/ringpenetration.py -> build/bdist.linux-armv7l/wheel/htmd/membranebuilder 2020-12-16T17:34:38,105 copying build/lib/htmd/membranebuilder/build_membrane.py -> build/bdist.linux-armv7l/wheel/htmd/membranebuilder 2020-12-16T17:34:38,107 copying build/lib/htmd/membranebuilder/pdbreporter.py -> build/bdist.linux-armv7l/wheel/htmd/membranebuilder 2020-12-16T17:34:38,110 copying build/lib/htmd/membranebuilder/ljfluid.py -> build/bdist.linux-armv7l/wheel/htmd/membranebuilder 2020-12-16T17:34:38,112 copying build/lib/htmd/membranebuilder/globalminimization.py -> build/bdist.linux-armv7l/wheel/htmd/membranebuilder 2020-12-16T17:34:38,115 copying build/lib/htmd/membranebuilder/simulate_openmm.py -> build/bdist.linux-armv7l/wheel/htmd/membranebuilder 2020-12-16T17:34:38,118 creating build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,119 copying build/lib/htmd/projections/tica.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,122 copying build/lib/htmd/projections/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,124 copying build/lib/htmd/projections/metriccoordinate.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,126 copying build/lib/htmd/projections/kmeanstri.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,128 copying build/lib/htmd/projections/metrictmscore.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,130 copying build/lib/htmd/projections/metricsecondarystructure.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,133 copying build/lib/htmd/projections/metricplumed2.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,135 copying build/lib/htmd/projections/metricsasa.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,137 copying build/lib/htmd/projections/metricdistance.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,139 copying build/lib/htmd/projections/metricsphericalcoordinate.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,141 copying build/lib/htmd/projections/metricrmsd.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,143 copying build/lib/htmd/projections/metric.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,146 copying build/lib/htmd/projections/gwpca.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,148 copying build/lib/htmd/projections/metricdihedral.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,150 copying build/lib/htmd/projections/metricfluctuation.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,152 copying build/lib/htmd/projections/metricshell.py -> build/bdist.linux-armv7l/wheel/htmd/projections 2020-12-16T17:34:38,155 creating build/bdist.linux-armv7l/wheel/htmd/builder 2020-12-16T17:34:38,156 copying build/lib/htmd/builder/loopmodeler.py -> build/bdist.linux-armv7l/wheel/htmd/builder 2020-12-16T17:34:38,158 copying build/lib/htmd/builder/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/builder 2020-12-16T17:34:38,160 copying build/lib/htmd/builder/preparation.py -> build/bdist.linux-armv7l/wheel/htmd/builder 2020-12-16T17:34:38,162 copying build/lib/htmd/builder/charmm.py -> build/bdist.linux-armv7l/wheel/htmd/builder 2020-12-16T17:34:38,166 copying build/lib/htmd/builder/builder.py -> build/bdist.linux-armv7l/wheel/htmd/builder 2020-12-16T17:34:38,168 copying build/lib/htmd/builder/solvate.py -> build/bdist.linux-armv7l/wheel/htmd/builder 2020-12-16T17:34:38,171 copying build/lib/htmd/builder/ionize.py -> build/bdist.linux-armv7l/wheel/htmd/builder 2020-12-16T17:34:38,173 copying build/lib/htmd/builder/amber.py -> build/bdist.linux-armv7l/wheel/htmd/builder 2020-12-16T17:34:38,177 copying build/lib/htmd/parallelprogress.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,179 copying build/lib/htmd/units.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,182 creating build/bdist.linux-armv7l/wheel/htmd/apps 2020-12-16T17:34:38,183 copying build/lib/htmd/apps/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/apps 2020-12-16T17:34:38,185 copying build/lib/htmd/apps/pmemd.py -> build/bdist.linux-armv7l/wheel/htmd/apps 2020-12-16T17:34:38,188 copying build/lib/htmd/apps/acemd.py -> build/bdist.linux-armv7l/wheel/htmd/apps 2020-12-16T17:34:38,191 copying build/lib/htmd/config.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,194 creating build/bdist.linux-armv7l/wheel/htmd/share 2020-12-16T17:34:38,196 creating build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder 2020-12-16T17:34:38,198 creating build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids 2020-12-16T17:34:38,200 creating build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids/pope 2020-12-16T17:34:38,201 copying build/lib/htmd/share/membranebuilder/lipids/pope/pope.pdb -> build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids/pope 2020-12-16T17:34:38,205 creating build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids/chl1 2020-12-16T17:34:38,206 copying build/lib/htmd/share/membranebuilder/lipids/chl1/chl1.pdb -> build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids/chl1 2020-12-16T17:34:38,210 creating build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids/popc 2020-12-16T17:34:38,211 copying build/lib/htmd/share/membranebuilder/lipids/popc/popc.pdb -> build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids/popc 2020-12-16T17:34:38,215 creating build/bdist.linux-armv7l/wheel/htmd/share/builder 2020-12-16T17:34:38,217 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles 2020-12-16T17:34:38,219 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,220 copying build/lib/htmd/share/builder/charmmfiles/par/par_all22star_prot.prm -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,229 copying build/lib/htmd/share/builder/charmmfiles/par/par_all35_ethers.prm -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,232 copying build/lib/htmd/share/builder/charmmfiles/par/par_all22_prot.prm -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,240 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36_lipid.prm -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,244 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36_na.prm -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,248 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36_prot.prm -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,257 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36m_prot.prm -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,267 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36_cgenff.prm -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,290 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36_carb.prm -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,296 copying build/lib/htmd/share/builder/charmmfiles/par/par_water_ions.prm -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2020-12-16T17:34:38,299 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:38,300 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_carb.rtf -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:38,309 copying build/lib/htmd/share/builder/charmmfiles/top/top_all35_ethers.rtf -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:38,312 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_na.rtf -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:38,316 copying build/lib/htmd/share/builder/charmmfiles/top/top_all22_prot.rtf -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:38,320 copying build/lib/htmd/share/builder/charmmfiles/top/top_water_ions.rtf -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:38,322 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_lipid.rtf -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:38,343 copying build/lib/htmd/share/builder/charmmfiles/top/top_all22star_prot.rtf -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:38,349 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_prot.rtf -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:38,354 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_cgenff.rtf -> build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2020-12-16T17:34:38,396 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles 2020-12-16T17:34:38,398 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,400 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HLX.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,402 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MLZ.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,404 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MMO.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,406 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ALC.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,408 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/TRO.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,410 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NVA.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,412 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/LME.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,414 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/2AS.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,416 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/AA4.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,419 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/IGL.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,422 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NLE.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,424 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ffncaa.in -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,432 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/OCY.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,434 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/TY2.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,437 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/YCM.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,439 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/2ML.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,441 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HQA.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,444 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/README.txt -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,447 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/YNM.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,449 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/4PH.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,452 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/OMX.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,454 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/004.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,469 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/GHG.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,470 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/0BN.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,470 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HPE.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,470 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/DPP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,471 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/5JP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,471 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/I2M.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,471 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/0A1.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,479 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/D4P.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,479 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/FGL.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,479 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ONL.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,480 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/DAB.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,482 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ME0.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,484 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/1MH.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,486 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/2GX.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,487 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MLE.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,489 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/LMQ.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,491 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ABA.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,493 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HHK.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,495 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MME.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,497 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HOX.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,500 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MEN.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,502 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NZC.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,504 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/CCS.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,506 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ESC.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,509 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/4IN.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,511 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MEQ.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,513 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/IIL.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,515 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/BCS.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,518 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NAL.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,520 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/TYQ.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,522 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MVA.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,524 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/KYN.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,527 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HTR.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,529 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HLU.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,531 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/CSA.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,533 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/APD.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,535 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/03Y.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,538 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MEA.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,540 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NCY.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,542 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/AHP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,544 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/GNC.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,547 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/IML.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,549 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/GME.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,551 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ALN.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,553 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/BB8.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2020-12-16T17:34:38,556 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:38,557 copying build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15/ff-nucleic-OL15.lib -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:38,563 copying build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15/README.txt -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:38,565 copying build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15/leap-ff-nucleic-OL15.in -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:38,567 copying build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15/leap.log -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:38,570 copying build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15/leaprc.ff-nucleic-OL15 -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:38,572 copying build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15/ff-nucleic-OL15.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-nucleic-OL15 2020-12-16T17:34:38,576 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,577 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CSP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,579 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/HYP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,581 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/PRK.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,583 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CGU.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,586 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/PTR.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,588 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/4PQ.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,590 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/DAH.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,592 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/SEP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,595 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/2MR.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,597 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/P1L.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,599 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/BTK.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,601 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/README.txt -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,604 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/M3L.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,607 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/HY3.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,609 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/LYZ.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,612 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/0AF.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,614 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/ORM.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,617 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/ALY.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,620 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CSO.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,623 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CSS.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,625 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/MLY.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,628 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/TPO.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,631 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/ffptm.in -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,636 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/PCA.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,639 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/DA2.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2020-12-16T17:34:38,642 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,643 copying build/lib/htmd/share/builder/amberfiles/cofactors/HEM.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,646 copying build/lib/htmd/share/builder/amberfiles/cofactors/NAD.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,649 copying build/lib/htmd/share/builder/amberfiles/cofactors/ADP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,651 copying build/lib/htmd/share/builder/amberfiles/cofactors/ATP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,654 copying build/lib/htmd/share/builder/amberfiles/cofactors/README.txt -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,656 copying build/lib/htmd/share/builder/amberfiles/cofactors/NAI.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,659 copying build/lib/htmd/share/builder/amberfiles/cofactors/AMP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,661 copying build/lib/htmd/share/builder/amberfiles/cofactors/GDP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,664 copying build/lib/htmd/share/builder/amberfiles/cofactors/GTP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,667 copying build/lib/htmd/share/builder/amberfiles/cofactors/NAP.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,669 copying build/lib/htmd/share/builder/amberfiles/cofactors/cofactors.in -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,673 copying build/lib/htmd/share/builder/amberfiles/cofactors/FMN.frcmod -> build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2020-12-16T17:34:38,676 creating build/bdist.linux-armv7l/wheel/htmd/share/mdengine 2020-12-16T17:34:38,678 creating build/bdist.linux-armv7l/wheel/htmd/share/mdengine/acemd 2020-12-16T17:34:38,680 creating build/bdist.linux-armv7l/wheel/htmd/share/mdengine/acemd/config 2020-12-16T17:34:38,682 copying build/lib/htmd/share/mdengine/acemd/config/production.json -> build/bdist.linux-armv7l/wheel/htmd/share/mdengine/acemd/config 2020-12-16T17:34:38,685 copying build/lib/htmd/share/mdengine/acemd/config/equilibration.json -> build/bdist.linux-armv7l/wheel/htmd/share/mdengine/acemd/config 2020-12-16T17:34:38,688 copying build/lib/htmd/logging.ini -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,690 copying build/lib/htmd/version.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,693 creating build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,695 copying build/lib/htmd/protocols/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,697 copying build/lib/htmd/protocols/production_v4.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,701 copying build/lib/htmd/protocols/equilibration_v3.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,704 copying build/lib/htmd/protocols/pmemdproduction.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,707 copying build/lib/htmd/protocols/equilibration_v1.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,711 copying build/lib/htmd/protocols/production_v2.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,714 copying build/lib/htmd/protocols/production_v3.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,717 copying build/lib/htmd/protocols/oldprotocolinterface.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,720 copying build/lib/htmd/protocols/production_v5.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,724 copying build/lib/htmd/protocols/equilibration_v2.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,727 copying build/lib/htmd/protocols/production_v6.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,730 copying build/lib/htmd/protocols/production_v1.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,733 copying build/lib/htmd/protocols/pmemdequilibration.py -> build/bdist.linux-armv7l/wheel/htmd/protocols 2020-12-16T17:34:38,736 copying build/lib/htmd/kineticshmm.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,739 copying build/lib/htmd/ui.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,742 creating build/bdist.linux-armv7l/wheel/htmd/molecule 2020-12-16T17:34:38,744 copying build/lib/htmd/molecule/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/molecule 2020-12-16T17:34:38,746 copying build/lib/htmd/molecule/molecule.py -> build/bdist.linux-armv7l/wheel/htmd/molecule 2020-12-16T17:34:38,748 copying build/lib/htmd/molecule/util.py -> build/bdist.linux-armv7l/wheel/htmd/molecule 2020-12-16T17:34:38,751 copying build/lib/htmd/util.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,754 copying build/lib/htmd/kinetics.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,757 copying build/lib/htmd/decorators.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,760 copying build/lib/htmd/pathplanning.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,763 copying build/lib/htmd/simlist.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,766 copying build/lib/htmd/dock.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,769 copying build/lib/htmd/mutualinformation.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,772 copying build/lib/htmd/metricdata.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,777 creating build/bdist.linux-armv7l/wheel/htmd/mdengine 2020-12-16T17:34:38,779 copying build/lib/htmd/mdengine/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/mdengine 2020-12-16T17:34:38,782 creating build/bdist.linux-armv7l/wheel/htmd/mdengine/acemd 2020-12-16T17:34:38,784 copying build/lib/htmd/mdengine/acemd/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/mdengine/acemd 2020-12-16T17:34:38,786 copying build/lib/htmd/mdengine/acemd/acemd.py -> build/bdist.linux-armv7l/wheel/htmd/mdengine/acemd 2020-12-16T17:34:38,790 copying build/lib/htmd/session.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,794 creating build/bdist.linux-armv7l/wheel/htmd/clustering 2020-12-16T17:34:38,795 copying build/lib/htmd/clustering/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/clustering 2020-12-16T17:34:38,798 copying build/lib/htmd/clustering/kcenters.py -> build/bdist.linux-armv7l/wheel/htmd/clustering 2020-12-16T17:34:38,801 copying build/lib/htmd/clustering/regular.py -> build/bdist.linux-armv7l/wheel/htmd/clustering 2020-12-16T17:34:38,804 copying build/lib/htmd/home.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,807 creating build/bdist.linux-armv7l/wheel/htmd/adaptive 2020-12-16T17:34:38,809 copying build/lib/htmd/adaptive/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/adaptive 2020-12-16T17:34:38,811 copying build/lib/htmd/adaptive/adaptiverun.py -> build/bdist.linux-armv7l/wheel/htmd/adaptive 2020-12-16T17:34:38,814 copying build/lib/htmd/adaptive/adaptivegoal.py -> build/bdist.linux-armv7l/wheel/htmd/adaptive 2020-12-16T17:34:38,818 copying build/lib/htmd/adaptive/adaptivebandit.py -> build/bdist.linux-armv7l/wheel/htmd/adaptive 2020-12-16T17:34:38,821 copying build/lib/htmd/adaptive/adaptive.py -> build/bdist.linux-armv7l/wheel/htmd/adaptive 2020-12-16T17:34:38,824 copying build/lib/htmd/adaptive/util.py -> build/bdist.linux-armv7l/wheel/htmd/adaptive 2020-12-16T17:34:38,827 copying build/lib/htmd/adaptive/adaptivegoaleg.py -> build/bdist.linux-armv7l/wheel/htmd/adaptive 2020-12-16T17:34:38,830 copying build/lib/htmd/model.py -> build/bdist.linux-armv7l/wheel/htmd 2020-12-16T17:34:38,835 creating build/bdist.linux-armv7l/wheel/htmd/queues 2020-12-16T17:34:38,836 copying build/lib/htmd/queues/__init__.py -> build/bdist.linux-armv7l/wheel/htmd/queues 2020-12-16T17:34:38,839 copying build/lib/htmd/queues/slurmqueue.py -> build/bdist.linux-armv7l/wheel/htmd/queues 2020-12-16T17:34:38,841 copying build/lib/htmd/queues/simqueue.py -> build/bdist.linux-armv7l/wheel/htmd/queues 2020-12-16T17:34:38,844 copying build/lib/htmd/queues/pbsqueue.py -> build/bdist.linux-armv7l/wheel/htmd/queues 2020-12-16T17:34:38,846 copying build/lib/htmd/queues/lsfqueue.py -> build/bdist.linux-armv7l/wheel/htmd/queues 2020-12-16T17:34:38,849 copying build/lib/htmd/queues/playqueue.py -> build/bdist.linux-armv7l/wheel/htmd/queues 2020-12-16T17:34:38,852 copying build/lib/htmd/queues/localqueue.py -> build/bdist.linux-armv7l/wheel/htmd/queues 2020-12-16T17:34:38,854 running install_egg_info 2020-12-16T17:34:38,878 running egg_info 2020-12-16T17:34:38,879 writing acellera_htmd.egg-info/PKG-INFO 2020-12-16T17:34:38,881 writing dependency_links to acellera_htmd.egg-info/dependency_links.txt 2020-12-16T17:34:38,884 writing entry points to acellera_htmd.egg-info/entry_points.txt 2020-12-16T17:34:38,886 writing requirements to acellera_htmd.egg-info/requires.txt 2020-12-16T17:34:38,887 writing top-level names to acellera_htmd.egg-info/top_level.txt 2020-12-16T17:34:38,905 reading manifest file 'acellera_htmd.egg-info/SOURCES.txt' 2020-12-16T17:34:38,914 reading manifest template 'MANIFEST.in' 2020-12-16T17:34:38,916 warning: no previously-included files matching '*' found under directory 'htmd/data' 2020-12-16T17:34:38,917 warning: no previously-included files matching '*' found under directory 'data' 2020-12-16T17:34:38,918 warning: no files found matching 'HTMD_LICENSE.txt' 2020-12-16T17:34:38,934 writing manifest file 'acellera_htmd.egg-info/SOURCES.txt' 2020-12-16T17:34:38,936 Copying acellera_htmd.egg-info to build/bdist.linux-armv7l/wheel/acellera_htmd-0-py3.7.egg-info 2020-12-16T17:34:38,951 running install_scripts 2020-12-16T17:34:39,047 creating build/bdist.linux-armv7l/wheel/acellera_htmd-0.dist-info/WHEEL 2020-12-16T17:34:39,050 creating '/tmp/pip-wheel-63fhyo8u/acellera_htmd-0-py3-none-any.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2020-12-16T17:34:39,055 adding 'htmd/__init__.py' 2020-12-16T17:34:39,057 adding 'htmd/config.py' 2020-12-16T17:34:39,059 adding 'htmd/decorators.py' 2020-12-16T17:34:39,061 adding 'htmd/dock.py' 2020-12-16T17:34:39,063 adding 'htmd/home.py' 2020-12-16T17:34:39,066 adding 'htmd/kinetics.py' 2020-12-16T17:34:39,069 adding 'htmd/kineticshmm.py' 2020-12-16T17:34:39,071 adding 'htmd/latest.py' 2020-12-16T17:34:39,073 adding 'htmd/logging.ini' 2020-12-16T17:34:39,079 adding 'htmd/metricdata.py' 2020-12-16T17:34:39,087 adding 'htmd/model.py' 2020-12-16T17:34:39,089 adding 'htmd/modelhmm.py' 2020-12-16T17:34:39,092 adding 'htmd/mutualinformation.py' 2020-12-16T17:34:39,093 adding 'htmd/numbautil.py' 2020-12-16T17:34:39,095 adding 'htmd/parallelprogress.py' 2020-12-16T17:34:39,097 adding 'htmd/pathplanning.py' 2020-12-16T17:34:39,099 adding 'htmd/session.py' 2020-12-16T17:34:39,102 adding 'htmd/simlist.py' 2020-12-16T17:34:39,104 adding 'htmd/ui.py' 2020-12-16T17:34:39,106 adding 'htmd/units.py' 2020-12-16T17:34:39,108 adding 'htmd/util.py' 2020-12-16T17:34:39,109 adding 'htmd/version.py' 2020-12-16T17:34:39,111 adding 'htmd/versionwarnings.py' 2020-12-16T17:34:39,113 adding 'htmd/adaptive/__init__.py' 2020-12-16T17:34:39,116 adding 'htmd/adaptive/adaptive.py' 2020-12-16T17:34:39,120 adding 'htmd/adaptive/adaptivebandit.py' 2020-12-16T17:34:39,123 adding 'htmd/adaptive/adaptivegoal.py' 2020-12-16T17:34:39,126 adding 'htmd/adaptive/adaptivegoaleg.py' 2020-12-16T17:34:39,128 adding 'htmd/adaptive/adaptiverun.py' 2020-12-16T17:34:39,130 adding 'htmd/adaptive/util.py' 2020-12-16T17:34:39,132 adding 'htmd/apps/__init__.py' 2020-12-16T17:34:39,134 adding 'htmd/apps/acemd.py' 2020-12-16T17:34:39,138 adding 'htmd/apps/pmemd.py' 2020-12-16T17:34:39,140 adding 'htmd/builder/__init__.py' 2020-12-16T17:34:39,147 adding 'htmd/builder/amber.py' 2020-12-16T17:34:39,150 adding 'htmd/builder/builder.py' 2020-12-16T17:34:39,155 adding 'htmd/builder/charmm.py' 2020-12-16T17:34:39,158 adding 'htmd/builder/ionize.py' 2020-12-16T17:34:39,160 adding 'htmd/builder/loopmodeler.py' 2020-12-16T17:34:39,161 adding 'htmd/builder/preparation.py' 2020-12-16T17:34:39,163 adding 'htmd/builder/solvate.py' 2020-12-16T17:34:39,166 adding 'htmd/clustering/__init__.py' 2020-12-16T17:34:39,167 adding 'htmd/clustering/kcenters.py' 2020-12-16T17:34:39,170 adding 'htmd/clustering/regular.py' 2020-12-16T17:34:39,172 adding 'htmd/mdengine/__init__.py' 2020-12-16T17:34:39,174 adding 'htmd/mdengine/acemd/__init__.py' 2020-12-16T17:34:39,178 adding 'htmd/mdengine/acemd/acemd.py' 2020-12-16T17:34:39,181 adding 'htmd/membranebuilder/__init__.py' 2020-12-16T17:34:39,183 adding 'htmd/membranebuilder/build_membrane.py' 2020-12-16T17:34:39,185 adding 'htmd/membranebuilder/globalminimization.py' 2020-12-16T17:34:39,187 adding 'htmd/membranebuilder/ljfluid.py' 2020-12-16T17:34:39,189 adding 'htmd/membranebuilder/pdbreporter.py' 2020-12-16T17:34:39,191 adding 'htmd/membranebuilder/ringpenetration.py' 2020-12-16T17:34:39,193 adding 'htmd/membranebuilder/simulate_openmm.py' 2020-12-16T17:34:39,195 adding 'htmd/molecule/__init__.py' 2020-12-16T17:34:39,197 adding 'htmd/molecule/molecule.py' 2020-12-16T17:34:39,198 adding 'htmd/molecule/util.py' 2020-12-16T17:34:39,200 adding 'htmd/projections/__init__.py' 2020-12-16T17:34:39,202 adding 'htmd/projections/gwpca.py' 2020-12-16T17:34:39,204 adding 'htmd/projections/kmeanstri.py' 2020-12-16T17:34:39,207 adding 'htmd/projections/metric.py' 2020-12-16T17:34:39,208 adding 'htmd/projections/metriccoordinate.py' 2020-12-16T17:34:39,210 adding 'htmd/projections/metricdihedral.py' 2020-12-16T17:34:39,211 adding 'htmd/projections/metricdistance.py' 2020-12-16T17:34:39,213 adding 'htmd/projections/metricfluctuation.py' 2020-12-16T17:34:39,214 adding 'htmd/projections/metricplumed2.py' 2020-12-16T17:34:39,216 adding 'htmd/projections/metricrmsd.py' 2020-12-16T17:34:39,217 adding 'htmd/projections/metricsasa.py' 2020-12-16T17:34:39,219 adding 'htmd/projections/metricsecondarystructure.py' 2020-12-16T17:34:39,220 adding 'htmd/projections/metricshell.py' 2020-12-16T17:34:39,222 adding 'htmd/projections/metricsphericalcoordinate.py' 2020-12-16T17:34:39,223 adding 'htmd/projections/metrictmscore.py' 2020-12-16T17:34:39,225 adding 'htmd/projections/tica.py' 2020-12-16T17:34:39,228 adding 'htmd/protocols/__init__.py' 2020-12-16T17:34:39,230 adding 'htmd/protocols/equilibration_v1.py' 2020-12-16T17:34:39,234 adding 'htmd/protocols/equilibration_v2.py' 2020-12-16T17:34:39,240 adding 'htmd/protocols/equilibration_v3.py' 2020-12-16T17:34:39,243 adding 'htmd/protocols/oldprotocolinterface.py' 2020-12-16T17:34:39,245 adding 'htmd/protocols/pmemdequilibration.py' 2020-12-16T17:34:39,247 adding 'htmd/protocols/pmemdproduction.py' 2020-12-16T17:34:39,249 adding 'htmd/protocols/production_v1.py' 2020-12-16T17:34:39,251 adding 'htmd/protocols/production_v2.py' 2020-12-16T17:34:39,254 adding 'htmd/protocols/production_v3.py' 2020-12-16T17:34:39,254 adding 'htmd/protocols/production_v4.py' 2020-12-16T17:34:39,257 adding 'htmd/protocols/production_v5.py' 2020-12-16T17:34:39,259 adding 'htmd/protocols/production_v6.py' 2020-12-16T17:34:39,261 adding 'htmd/queues/__init__.py' 2020-12-16T17:34:39,263 adding 'htmd/queues/localqueue.py' 2020-12-16T17:34:39,264 adding 'htmd/queues/lsfqueue.py' 2020-12-16T17:34:39,265 adding 'htmd/queues/pbsqueue.py' 2020-12-16T17:34:39,266 adding 'htmd/queues/playqueue.py' 2020-12-16T17:34:39,267 adding 'htmd/queues/simqueue.py' 2020-12-16T17:34:39,268 adding 'htmd/queues/slurmqueue.py' 2020-12-16T17:34:39,273 adding 'htmd/share/builder/amberfiles/cofactors/ADP.frcmod' 2020-12-16T17:34:39,274 adding 'htmd/share/builder/amberfiles/cofactors/AMP.frcmod' 2020-12-16T17:34:39,275 adding 'htmd/share/builder/amberfiles/cofactors/ATP.frcmod' 2020-12-16T17:34:39,277 adding 'htmd/share/builder/amberfiles/cofactors/FMN.frcmod' 2020-12-16T17:34:39,278 adding 'htmd/share/builder/amberfiles/cofactors/GDP.frcmod' 2020-12-16T17:34:39,279 adding 'htmd/share/builder/amberfiles/cofactors/GTP.frcmod' 2020-12-16T17:34:39,281 adding 'htmd/share/builder/amberfiles/cofactors/HEM.frcmod' 2020-12-16T17:34:39,282 adding 'htmd/share/builder/amberfiles/cofactors/NAD.frcmod' 2020-12-16T17:34:39,283 adding 'htmd/share/builder/amberfiles/cofactors/NAI.frcmod' 2020-12-16T17:34:39,284 adding 'htmd/share/builder/amberfiles/cofactors/NAP.frcmod' 2020-12-16T17:34:39,286 adding 'htmd/share/builder/amberfiles/cofactors/README.txt' 2020-12-16T17:34:39,295 adding 'htmd/share/builder/amberfiles/cofactors/cofactors.in' 2020-12-16T17:34:39,299 adding 'htmd/share/builder/amberfiles/ff-ncaa/004.frcmod' 2020-12-16T17:34:39,300 adding 'htmd/share/builder/amberfiles/ff-ncaa/03Y.frcmod' 2020-12-16T17:34:39,301 adding 'htmd/share/builder/amberfiles/ff-ncaa/0A1.frcmod' 2020-12-16T17:34:39,303 adding 'htmd/share/builder/amberfiles/ff-ncaa/0BN.frcmod' 2020-12-16T17:34:39,304 adding 'htmd/share/builder/amberfiles/ff-ncaa/1MH.frcmod' 2020-12-16T17:34:39,305 adding 'htmd/share/builder/amberfiles/ff-ncaa/2AS.frcmod' 2020-12-16T17:34:39,306 adding 'htmd/share/builder/amberfiles/ff-ncaa/2GX.frcmod' 2020-12-16T17:34:39,307 adding 'htmd/share/builder/amberfiles/ff-ncaa/2ML.frcmod' 2020-12-16T17:34:39,308 adding 'htmd/share/builder/amberfiles/ff-ncaa/4IN.frcmod' 2020-12-16T17:34:39,309 adding 'htmd/share/builder/amberfiles/ff-ncaa/4PH.frcmod' 2020-12-16T17:34:39,310 adding 'htmd/share/builder/amberfiles/ff-ncaa/5JP.frcmod' 2020-12-16T17:34:39,311 adding 'htmd/share/builder/amberfiles/ff-ncaa/AA4.frcmod' 2020-12-16T17:34:39,313 adding 'htmd/share/builder/amberfiles/ff-ncaa/ABA.frcmod' 2020-12-16T17:34:39,314 adding 'htmd/share/builder/amberfiles/ff-ncaa/AHP.frcmod' 2020-12-16T17:34:39,315 adding 'htmd/share/builder/amberfiles/ff-ncaa/ALC.frcmod' 2020-12-16T17:34:39,316 adding 'htmd/share/builder/amberfiles/ff-ncaa/ALN.frcmod' 2020-12-16T17:34:39,317 adding 'htmd/share/builder/amberfiles/ff-ncaa/APD.frcmod' 2020-12-16T17:34:39,318 adding 'htmd/share/builder/amberfiles/ff-ncaa/BB8.frcmod' 2020-12-16T17:34:39,319 adding 'htmd/share/builder/amberfiles/ff-ncaa/BCS.frcmod' 2020-12-16T17:34:39,320 adding 'htmd/share/builder/amberfiles/ff-ncaa/CCS.frcmod' 2020-12-16T17:34:39,321 adding 'htmd/share/builder/amberfiles/ff-ncaa/CSA.frcmod' 2020-12-16T17:34:39,323 adding 'htmd/share/builder/amberfiles/ff-ncaa/D4P.frcmod' 2020-12-16T17:34:39,324 adding 'htmd/share/builder/amberfiles/ff-ncaa/DAB.frcmod' 2020-12-16T17:34:39,325 adding 'htmd/share/builder/amberfiles/ff-ncaa/DPP.frcmod' 2020-12-16T17:34:39,326 adding 'htmd/share/builder/amberfiles/ff-ncaa/ESC.frcmod' 2020-12-16T17:34:39,327 adding 'htmd/share/builder/amberfiles/ff-ncaa/FGL.frcmod' 2020-12-16T17:34:39,329 adding 'htmd/share/builder/amberfiles/ff-ncaa/GHG.frcmod' 2020-12-16T17:34:39,330 adding 'htmd/share/builder/amberfiles/ff-ncaa/GME.frcmod' 2020-12-16T17:34:39,331 adding 'htmd/share/builder/amberfiles/ff-ncaa/GNC.frcmod' 2020-12-16T17:34:39,332 adding 'htmd/share/builder/amberfiles/ff-ncaa/HHK.frcmod' 2020-12-16T17:34:39,333 adding 'htmd/share/builder/amberfiles/ff-ncaa/HLU.frcmod' 2020-12-16T17:34:39,334 adding 'htmd/share/builder/amberfiles/ff-ncaa/HLX.frcmod' 2020-12-16T17:34:39,335 adding 'htmd/share/builder/amberfiles/ff-ncaa/HOX.frcmod' 2020-12-16T17:34:39,336 adding 'htmd/share/builder/amberfiles/ff-ncaa/HPE.frcmod' 2020-12-16T17:34:39,338 adding 'htmd/share/builder/amberfiles/ff-ncaa/HQA.frcmod' 2020-12-16T17:34:39,339 adding 'htmd/share/builder/amberfiles/ff-ncaa/HTR.frcmod' 2020-12-16T17:34:39,340 adding 'htmd/share/builder/amberfiles/ff-ncaa/I2M.frcmod' 2020-12-16T17:34:39,341 adding 'htmd/share/builder/amberfiles/ff-ncaa/IGL.frcmod' 2020-12-16T17:34:39,342 adding 'htmd/share/builder/amberfiles/ff-ncaa/IIL.frcmod' 2020-12-16T17:34:39,343 adding 'htmd/share/builder/amberfiles/ff-ncaa/IML.frcmod' 2020-12-16T17:34:39,345 adding 'htmd/share/builder/amberfiles/ff-ncaa/KYN.frcmod' 2020-12-16T17:34:39,346 adding 'htmd/share/builder/amberfiles/ff-ncaa/LME.frcmod' 2020-12-16T17:34:39,347 adding 'htmd/share/builder/amberfiles/ff-ncaa/LMQ.frcmod' 2020-12-16T17:34:39,348 adding 'htmd/share/builder/amberfiles/ff-ncaa/ME0.frcmod' 2020-12-16T17:34:39,349 adding 'htmd/share/builder/amberfiles/ff-ncaa/MEA.frcmod' 2020-12-16T17:34:39,350 adding 'htmd/share/builder/amberfiles/ff-ncaa/MEN.frcmod' 2020-12-16T17:34:39,352 adding 'htmd/share/builder/amberfiles/ff-ncaa/MEQ.frcmod' 2020-12-16T17:34:39,353 adding 'htmd/share/builder/amberfiles/ff-ncaa/MLE.frcmod' 2020-12-16T17:34:39,354 adding 'htmd/share/builder/amberfiles/ff-ncaa/MLZ.frcmod' 2020-12-16T17:34:39,355 adding 'htmd/share/builder/amberfiles/ff-ncaa/MME.frcmod' 2020-12-16T17:34:39,356 adding 'htmd/share/builder/amberfiles/ff-ncaa/MMO.frcmod' 2020-12-16T17:34:39,357 adding 'htmd/share/builder/amberfiles/ff-ncaa/MVA.frcmod' 2020-12-16T17:34:39,359 adding 'htmd/share/builder/amberfiles/ff-ncaa/NAL.frcmod' 2020-12-16T17:34:39,360 adding 'htmd/share/builder/amberfiles/ff-ncaa/NCY.frcmod' 2020-12-16T17:34:39,361 adding 'htmd/share/builder/amberfiles/ff-ncaa/NLE.frcmod' 2020-12-16T17:34:39,362 adding 'htmd/share/builder/amberfiles/ff-ncaa/NVA.frcmod' 2020-12-16T17:34:39,363 adding 'htmd/share/builder/amberfiles/ff-ncaa/NZC.frcmod' 2020-12-16T17:34:39,364 adding 'htmd/share/builder/amberfiles/ff-ncaa/OCY.frcmod' 2020-12-16T17:34:39,366 adding 'htmd/share/builder/amberfiles/ff-ncaa/OMX.frcmod' 2020-12-16T17:34:39,367 adding 'htmd/share/builder/amberfiles/ff-ncaa/ONL.frcmod' 2020-12-16T17:34:39,368 adding 'htmd/share/builder/amberfiles/ff-ncaa/README.txt' 2020-12-16T17:34:39,369 adding 'htmd/share/builder/amberfiles/ff-ncaa/TRO.frcmod' 2020-12-16T17:34:39,371 adding 'htmd/share/builder/amberfiles/ff-ncaa/TY2.frcmod' 2020-12-16T17:34:39,372 adding 'htmd/share/builder/amberfiles/ff-ncaa/TYQ.frcmod' 2020-12-16T17:34:39,373 adding 'htmd/share/builder/amberfiles/ff-ncaa/YCM.frcmod' 2020-12-16T17:34:39,374 adding 'htmd/share/builder/amberfiles/ff-ncaa/YNM.frcmod' 2020-12-16T17:34:39,399 adding 'htmd/share/builder/amberfiles/ff-ncaa/ffncaa.in' 2020-12-16T17:34:39,403 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/README.txt' 2020-12-16T17:34:39,405 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/ff-nucleic-OL15.frcmod' 2020-12-16T17:34:39,410 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/ff-nucleic-OL15.lib' 2020-12-16T17:34:39,412 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/leap-ff-nucleic-OL15.in' 2020-12-16T17:34:39,414 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/leap.log' 2020-12-16T17:34:39,415 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/leaprc.ff-nucleic-OL15' 2020-12-16T17:34:39,418 adding 'htmd/share/builder/amberfiles/ff-ptm/0AF.frcmod' 2020-12-16T17:34:39,419 adding 'htmd/share/builder/amberfiles/ff-ptm/2MR.frcmod' 2020-12-16T17:34:39,420 adding 'htmd/share/builder/amberfiles/ff-ptm/4PQ.frcmod' 2020-12-16T17:34:39,421 adding 'htmd/share/builder/amberfiles/ff-ptm/ALY.frcmod' 2020-12-16T17:34:39,422 adding 'htmd/share/builder/amberfiles/ff-ptm/BTK.frcmod' 2020-12-16T17:34:39,423 adding 'htmd/share/builder/amberfiles/ff-ptm/CGU.frcmod' 2020-12-16T17:34:39,424 adding 'htmd/share/builder/amberfiles/ff-ptm/CSO.frcmod' 2020-12-16T17:34:39,425 adding 'htmd/share/builder/amberfiles/ff-ptm/CSP.frcmod' 2020-12-16T17:34:39,427 adding 'htmd/share/builder/amberfiles/ff-ptm/CSS.frcmod' 2020-12-16T17:34:39,428 adding 'htmd/share/builder/amberfiles/ff-ptm/DA2.frcmod' 2020-12-16T17:34:39,429 adding 'htmd/share/builder/amberfiles/ff-ptm/DAH.frcmod' 2020-12-16T17:34:39,430 adding 'htmd/share/builder/amberfiles/ff-ptm/HY3.frcmod' 2020-12-16T17:34:39,431 adding 'htmd/share/builder/amberfiles/ff-ptm/HYP.frcmod' 2020-12-16T17:34:39,433 adding 'htmd/share/builder/amberfiles/ff-ptm/LYZ.frcmod' 2020-12-16T17:34:39,434 adding 'htmd/share/builder/amberfiles/ff-ptm/M3L.frcmod' 2020-12-16T17:34:39,435 adding 'htmd/share/builder/amberfiles/ff-ptm/MLY.frcmod' 2020-12-16T17:34:39,436 adding 'htmd/share/builder/amberfiles/ff-ptm/ORM.frcmod' 2020-12-16T17:34:39,437 adding 'htmd/share/builder/amberfiles/ff-ptm/P1L.frcmod' 2020-12-16T17:34:39,439 adding 'htmd/share/builder/amberfiles/ff-ptm/PCA.frcmod' 2020-12-16T17:34:39,440 adding 'htmd/share/builder/amberfiles/ff-ptm/PRK.frcmod' 2020-12-16T17:34:39,441 adding 'htmd/share/builder/amberfiles/ff-ptm/PTR.frcmod' 2020-12-16T17:34:39,442 adding 'htmd/share/builder/amberfiles/ff-ptm/README.txt' 2020-12-16T17:34:39,444 adding 'htmd/share/builder/amberfiles/ff-ptm/SEP.frcmod' 2020-12-16T17:34:39,445 adding 'htmd/share/builder/amberfiles/ff-ptm/TPO.frcmod' 2020-12-16T17:34:39,454 adding 'htmd/share/builder/amberfiles/ff-ptm/ffptm.in' 2020-12-16T17:34:39,472 adding 'htmd/share/builder/charmmfiles/par/par_all22_prot.prm' 2020-12-16T17:34:39,488 adding 'htmd/share/builder/charmmfiles/par/par_all22star_prot.prm' 2020-12-16T17:34:39,491 adding 'htmd/share/builder/charmmfiles/par/par_all35_ethers.prm' 2020-12-16T17:34:39,507 adding 'htmd/share/builder/charmmfiles/par/par_all36_carb.prm' 2020-12-16T17:34:39,561 adding 'htmd/share/builder/charmmfiles/par/par_all36_cgenff.prm' 2020-12-16T17:34:39,568 adding 'htmd/share/builder/charmmfiles/par/par_all36_lipid.prm' 2020-12-16T17:34:39,576 adding 'htmd/share/builder/charmmfiles/par/par_all36_na.prm' 2020-12-16T17:34:39,591 adding 'htmd/share/builder/charmmfiles/par/par_all36_prot.prm' 2020-12-16T17:34:39,607 adding 'htmd/share/builder/charmmfiles/par/par_all36m_prot.prm' 2020-12-16T17:34:39,610 adding 'htmd/share/builder/charmmfiles/par/par_water_ions.prm' 2020-12-16T17:34:39,619 adding 'htmd/share/builder/charmmfiles/top/top_all22_prot.rtf' 2020-12-16T17:34:39,630 adding 'htmd/share/builder/charmmfiles/top/top_all22star_prot.rtf' 2020-12-16T17:34:39,637 adding 'htmd/share/builder/charmmfiles/top/top_all35_ethers.rtf' 2020-12-16T17:34:39,664 adding 'htmd/share/builder/charmmfiles/top/top_all36_carb.rtf' 2020-12-16T17:34:39,830 adding 'htmd/share/builder/charmmfiles/top/top_all36_cgenff.rtf' 2020-12-16T17:34:39,915 adding 'htmd/share/builder/charmmfiles/top/top_all36_lipid.rtf' 2020-12-16T17:34:39,923 adding 'htmd/share/builder/charmmfiles/top/top_all36_na.rtf' 2020-12-16T17:34:39,933 adding 'htmd/share/builder/charmmfiles/top/top_all36_prot.rtf' 2020-12-16T17:34:39,935 adding 'htmd/share/builder/charmmfiles/top/top_water_ions.rtf' 2020-12-16T17:34:39,938 adding 'htmd/share/mdengine/acemd/config/equilibration.json' 2020-12-16T17:34:39,939 adding 'htmd/share/mdengine/acemd/config/production.json' 2020-12-16T17:34:39,942 adding 'htmd/share/membranebuilder/lipids/chl1/chl1.pdb' 2020-12-16T17:34:39,945 adding 'htmd/share/membranebuilder/lipids/popc/popc.pdb' 2020-12-16T17:34:39,948 adding 'htmd/share/membranebuilder/lipids/pope/pope.pdb' 2020-12-16T17:34:39,950 adding 'htmdx/__init__.py' 2020-12-16T17:34:39,951 adding 'htmdx/cli.py' 2020-12-16T17:34:39,953 adding 'htmdx/license.py' 2020-12-16T17:34:39,954 adding 'acellera_htmd-0.dist-info/METADATA' 2020-12-16T17:34:39,955 adding 'acellera_htmd-0.dist-info/WHEEL' 2020-12-16T17:34:39,956 adding 'acellera_htmd-0.dist-info/entry_points.txt' 2020-12-16T17:34:39,957 adding 'acellera_htmd-0.dist-info/top_level.txt' 2020-12-16T17:34:39,960 adding 'acellera_htmd-0.dist-info/RECORD' 2020-12-16T17:34:39,984 removing build/bdist.linux-armv7l/wheel 2020-12-16T17:34:40,162 Building wheel for acellera-htmd (setup.py): finished with status 'done' 2020-12-16T17:34:40,175 Created wheel for acellera-htmd: filename=acellera_htmd-0-py3-none-any.whl size=972074 sha256=5faae28b3355ac3a599fda507325bf63fef2e93ca3508ac1e166e52d000aa905 2020-12-16T17:34:40,176 Stored in directory: /tmp/pip-ephem-wheel-cache-yj05wvac/wheels/8c/aa/0a/34d540c8aee8b7af365b4c3a9cf3a1382a1f0270639bcb0d01 2020-12-16T17:34:40,178 Successfully built acellera-htmd 2020-12-16T17:34:40,221 Removed build tracker: '/tmp/pip-req-tracker-_8y5gnt8'