2026-04-13T19:41:02,504 Created temporary directory: /tmp/pip-ephem-wheel-cache-3x5hs962 2026-04-13T19:41:02,506 Created temporary directory: /tmp/pip-build-tracker-ukom60w8 2026-04-13T19:41:02,507 Initialized build tracking at /tmp/pip-build-tracker-ukom60w8 2026-04-13T19:41:02,507 Created build tracker: /tmp/pip-build-tracker-ukom60w8 2026-04-13T19:41:02,507 Entered build tracker: /tmp/pip-build-tracker-ukom60w8 2026-04-13T19:41:02,508 Created temporary directory: /tmp/pip-wheel-0ya4hjmy 2026-04-13T19:41:02,512 DEPRECATION: --no-binary currently disables reading from the cache of locally built wheels. In the future --no-binary will not influence the wheel cache. pip 23.1 will enforce this behaviour change. A possible replacement is to use the --no-cache-dir option. You can use the flag --use-feature=no-binary-enable-wheel-cache to test the upcoming behaviour. Discussion can be found at https://github.com/pypa/pip/issues/11453 2026-04-13T19:41:02,514 Created temporary directory: /tmp/pip-ephem-wheel-cache-8kyvtmt4 2026-04-13T19:41:02,535 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2026-04-13T19:41:02,539 2 location(s) to search for versions of acellera-htmd: 2026-04-13T19:41:02,539 * https://pypi.org/simple/acellera-htmd/ 2026-04-13T19:41:02,539 * https://www.piwheels.org/simple/acellera-htmd/ 2026-04-13T19:41:02,540 Fetching project page and analyzing links: https://pypi.org/simple/acellera-htmd/ 2026-04-13T19:41:02,541 Getting page https://pypi.org/simple/acellera-htmd/ 2026-04-13T19:41:02,542 Found index url https://pypi.org/simple 2026-04-13T19:41:02,771 Fetched page https://pypi.org/simple/acellera-htmd/ as application/vnd.pypi.simple.v1+json 2026-04-13T19:41:02,774 Found link https://files.pythonhosted.org/packages/7b/b5/296a5fe7573797fca6eb9e1820feaceb3e078cbd4905156960e9ba779fac/acellera-htmd-1.23.2.tar.gz (from https://pypi.org/simple/acellera-htmd/), version: 1.23.2 2026-04-13T19:41:02,776 Found link https://files.pythonhosted.org/packages/63/8e/389b32ca6a0789b30ad1483dbfeeb46916450ba1a1f6c953966e9903bbbb/acellera-htmd-1.23.4.tar.gz (from https://pypi.org/simple/acellera-htmd/), version: 1.23.4 2026-04-13T19:41:02,777 Found link https://files.pythonhosted.org/packages/5d/56/5d7e8d3d4f979cd97a540bedf4c4edc7268388c9eb450bc4af0ce0084f1f/acellera-htmd-1.23.5.tar.gz (from https://pypi.org/simple/acellera-htmd/), version: 1.23.5 2026-04-13T19:41:02,778 Found link https://files.pythonhosted.org/packages/f2/ef/f3b5c44015b5e51757d54f7d27c4208a618f609036e8517b083034dc1ada/acellera-htmd-1.23.6.tar.gz (from https://pypi.org/simple/acellera-htmd/), version: 1.23.6 2026-04-13T19:41:02,779 Found link https://files.pythonhosted.org/packages/46/22/b042ef04a3ddbe7e160d6923657f24d261aa175be0f93243e0259c287a57/acellera_htmd-2.5.8.tar.gz (from https://pypi.org/simple/acellera-htmd/) (requires-python:>=3.10), version: 2.5.8 2026-04-13T19:41:02,781 Found link https://files.pythonhosted.org/packages/f2/d7/997750fb042860ca38439ccb15237092722f451e4db538d3ccd421c6ff56/acellera_htmd-2.5.9.tar.gz (from https://pypi.org/simple/acellera-htmd/) (requires-python:>=3.10), version: 2.5.9 2026-04-13T19:41:02,782 Found link https://files.pythonhosted.org/packages/53/f3/0909deceb5515bce2a09c1bd405aa154ce25c2a9c9ee0955ef8b684b1b4e/acellera_htmd-2.6.0.tar.gz (from https://pypi.org/simple/acellera-htmd/) (requires-python:>=3.10), version: 2.6.0 2026-04-13T19:41:02,784 Found link https://files.pythonhosted.org/packages/c3/49/1143b30c950f6e2e2af252e852d5ebdb7e85bed42e351f8250032daed81f/acellera_htmd-2.6.1.tar.gz (from https://pypi.org/simple/acellera-htmd/) (requires-python:>=3.10), version: 2.6.1 2026-04-13T19:41:02,785 Fetching project page and analyzing links: https://www.piwheels.org/simple/acellera-htmd/ 2026-04-13T19:41:02,786 Getting page https://www.piwheels.org/simple/acellera-htmd/ 2026-04-13T19:41:02,788 Found index url https://www.piwheels.org/simple 2026-04-13T19:41:02,973 Fetched page https://www.piwheels.org/simple/acellera-htmd/ as text/html 2026-04-13T19:41:02,975 Skipping link: No binaries permitted for acellera-htmd: https://archive1.piwheels.org/simple/acellera-htmd/acellera_htmd-2.6.0-py3-none-any.whl#sha256=3490bfd57e9749c4dec60d86755e1ddbe9b92c9d7ae74c7aafaf9de45462c2e2 (from https://www.piwheels.org/simple/acellera-htmd/) (requires-python:>=3.10) 2026-04-13T19:41:02,976 Skipping link: No binaries permitted for acellera-htmd: https://archive1.piwheels.org/simple/acellera-htmd/acellera_htmd-2.5.9-py3-none-any.whl#sha256=c1a9ab1a067690bc9279663b8f510ad8644a8116f8bb2346393452050018b898 (from https://www.piwheels.org/simple/acellera-htmd/) (requires-python:>=3.10) 2026-04-13T19:41:02,977 Skipping link: No binaries permitted for acellera-htmd: https://archive1.piwheels.org/simple/acellera-htmd/acellera_htmd-2.5.8-py3-none-any.whl#sha256=f35d7d637d96979c3193449d0fa62cc53af299b6150e0febb9508b1a4e37072b (from https://www.piwheels.org/simple/acellera-htmd/) (requires-python:>=3.10) 2026-04-13T19:41:02,977 Skipping link: No binaries permitted for acellera-htmd: https://archive1.piwheels.org/simple/acellera-htmd/acellera_htmd-0-py3-none-any.whl#sha256=5faae28b3355ac3a599fda507325bf63fef2e93ca3508ac1e166e52d000aa905 (from https://www.piwheels.org/simple/acellera-htmd/) 2026-04-13T19:41:02,978 Skipping link: not a file: https://www.piwheels.org/simple/acellera-htmd/ 2026-04-13T19:41:02,978 Skipping link: not a file: https://pypi.org/simple/acellera-htmd/ 2026-04-13T19:41:02,999 Given no hashes to check 1 links for project 'acellera-htmd': discarding no candidates 2026-04-13T19:41:03,018 Collecting acellera-htmd==2.6.1 2026-04-13T19:41:03,020 Created temporary directory: /tmp/pip-unpack-ki7zvzzk 2026-04-13T19:41:03,173 Downloading acellera_htmd-2.6.1.tar.gz (4.0 MB) 2026-04-13T19:41:04,978 Added acellera-htmd==2.6.1 from https://files.pythonhosted.org/packages/c3/49/1143b30c950f6e2e2af252e852d5ebdb7e85bed42e351f8250032daed81f/acellera_htmd-2.6.1.tar.gz to build tracker '/tmp/pip-build-tracker-ukom60w8' 2026-04-13T19:41:04,984 Created temporary directory: /tmp/pip-build-env-99ze1ijo 2026-04-13T19:41:04,988 Installing build dependencies: started 2026-04-13T19:41:04,989 Running command pip subprocess to install build dependencies 2026-04-13T19:41:06,142 Using pip 23.0.1 from /usr/lib/python3/dist-packages/pip (python 3.11) 2026-04-13T19:41:06,632 DEPRECATION: --no-binary currently disables reading from the cache of locally built wheels. In the future --no-binary will not influence the wheel cache. pip 23.1 will enforce this behaviour change. A possible replacement is to use the --no-cache-dir option. You can use the flag --use-feature=no-binary-enable-wheel-cache to test the upcoming behaviour. Discussion can be found at https://github.com/pypa/pip/issues/11453 2026-04-13T19:41:06,655 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2026-04-13T19:41:08,423 Collecting setuptools 2026-04-13T19:41:08,506 Using cached https://www.piwheels.org/simple/setuptools/setuptools-82.0.1-py3-none-any.whl (1.0 MB) 2026-04-13T19:41:08,887 Collecting setuptools-scm>=8 2026-04-13T19:41:08,904 Using cached https://www.piwheels.org/simple/setuptools-scm/setuptools_scm-10.0.5-py3-none-any.whl (21 kB) 2026-04-13T19:41:08,990 Collecting vcs-versioning>=1.0.0.dev0 2026-04-13T19:41:09,009 Using cached https://www.piwheels.org/simple/vcs-versioning/vcs_versioning-1.1.1-py3-none-any.whl (79 kB) 2026-04-13T19:41:09,193 Collecting packaging>=20 2026-04-13T19:41:09,209 Using cached https://www.piwheels.org/simple/packaging/packaging-26.0-py3-none-any.whl (74 kB) 2026-04-13T19:41:12,237 Installing collected packages: setuptools, packaging, vcs-versioning, setuptools-scm 2026-04-13T19:41:15,921 Creating /tmp/pip-build-env-99ze1ijo/overlay/local/bin 2026-04-13T19:41:15,924 changing mode of /tmp/pip-build-env-99ze1ijo/overlay/local/bin/vcs-versioning to 755 2026-04-13T19:41:16,040 changing mode of /tmp/pip-build-env-99ze1ijo/overlay/local/bin/setuptools-scm to 755 2026-04-13T19:41:16,067 Successfully installed packaging-26.0 setuptools-82.0.1 setuptools-scm-10.0.5 vcs-versioning-1.1.1 2026-04-13T19:41:16,353 Installing build dependencies: finished with status 'done' 2026-04-13T19:41:16,359 Getting requirements to build wheel: started 2026-04-13T19:41:16,360 Running command Getting requirements to build wheel 2026-04-13T19:41:17,199 running egg_info 2026-04-13T19:41:17,207 writing acellera_htmd.egg-info/PKG-INFO 2026-04-13T19:41:17,212 writing dependency_links to acellera_htmd.egg-info/dependency_links.txt 2026-04-13T19:41:17,214 writing entry points to acellera_htmd.egg-info/entry_points.txt 2026-04-13T19:41:17,218 writing requirements to acellera_htmd.egg-info/requires.txt 2026-04-13T19:41:17,220 writing top-level names to acellera_htmd.egg-info/top_level.txt 2026-04-13T19:41:17,308 /tmp/pip-build-env-99ze1ijo/overlay/local/lib/python3.11/dist-packages/vcs_versioning/overrides.py:609: UserWarning: No GlobalOverrides context is active. Auto-creating one with SETUPTOOLS_SCM prefix for backwards compatibility. Consider using 'with GlobalOverrides.from_env("YOUR_TOOL"):' explicitly. 2026-04-13T19:41:17,309 return get_active_overrides().subprocess_timeout 2026-04-13T19:41:17,317 listing git files failed - pretending there aren't any 2026-04-13T19:41:17,322 reading manifest file 'acellera_htmd.egg-info/SOURCES.txt' 2026-04-13T19:41:17,342 reading manifest template 'MANIFEST.in' 2026-04-13T19:41:17,361 no previously-included directories found matching 'htmd/data' 2026-04-13T19:41:17,362 no previously-included directories found matching '.github' 2026-04-13T19:41:17,363 no previously-included directories found matching 'doc' 2026-04-13T19:41:17,364 no previously-included directories found matching 'package' 2026-04-13T19:41:17,365 no previously-included directories found matching 'tests' 2026-04-13T19:41:17,367 no previously-included directories found matching 'tutorials' 2026-04-13T19:41:17,368 warning: no previously-included files found matching 'Makefile' 2026-04-13T19:41:17,368 adding license file 'LICENSE' 2026-04-13T19:41:17,390 writing manifest file 'acellera_htmd.egg-info/SOURCES.txt' 2026-04-13T19:41:17,495 Getting requirements to build wheel: finished with status 'done' 2026-04-13T19:41:17,498 Created temporary directory: /tmp/pip-modern-metadata-k2xqe86g 2026-04-13T19:41:17,501 Preparing metadata (pyproject.toml): started 2026-04-13T19:41:17,502 Running command Preparing metadata (pyproject.toml) 2026-04-13T19:41:18,284 running dist_info 2026-04-13T19:41:18,298 creating /tmp/pip-modern-metadata-k2xqe86g/acellera_htmd.egg-info 2026-04-13T19:41:18,299 writing /tmp/pip-modern-metadata-k2xqe86g/acellera_htmd.egg-info/PKG-INFO 2026-04-13T19:41:18,304 writing dependency_links to /tmp/pip-modern-metadata-k2xqe86g/acellera_htmd.egg-info/dependency_links.txt 2026-04-13T19:41:18,305 writing entry points to /tmp/pip-modern-metadata-k2xqe86g/acellera_htmd.egg-info/entry_points.txt 2026-04-13T19:41:18,309 writing requirements to /tmp/pip-modern-metadata-k2xqe86g/acellera_htmd.egg-info/requires.txt 2026-04-13T19:41:18,310 writing top-level names to /tmp/pip-modern-metadata-k2xqe86g/acellera_htmd.egg-info/top_level.txt 2026-04-13T19:41:18,312 writing manifest file '/tmp/pip-modern-metadata-k2xqe86g/acellera_htmd.egg-info/SOURCES.txt' 2026-04-13T19:41:18,387 /tmp/pip-build-env-99ze1ijo/overlay/local/lib/python3.11/dist-packages/vcs_versioning/overrides.py:609: UserWarning: No GlobalOverrides context is active. Auto-creating one with SETUPTOOLS_SCM prefix for backwards compatibility. Consider using 'with GlobalOverrides.from_env("YOUR_TOOL"):' explicitly. 2026-04-13T19:41:18,387 return get_active_overrides().subprocess_timeout 2026-04-13T19:41:18,394 listing git files failed - pretending there aren't any 2026-04-13T19:41:18,399 reading manifest file '/tmp/pip-modern-metadata-k2xqe86g/acellera_htmd.egg-info/SOURCES.txt' 2026-04-13T19:41:18,401 reading manifest template 'MANIFEST.in' 2026-04-13T19:41:18,419 no previously-included directories found matching 'htmd/data' 2026-04-13T19:41:18,419 no previously-included directories found matching '.github' 2026-04-13T19:41:18,420 no previously-included directories found matching 'doc' 2026-04-13T19:41:18,422 no previously-included directories found matching 'package' 2026-04-13T19:41:18,423 no previously-included directories found matching 'tests' 2026-04-13T19:41:18,424 no previously-included directories found matching 'tutorials' 2026-04-13T19:41:18,425 warning: no previously-included files found matching 'Makefile' 2026-04-13T19:41:18,425 adding license file 'LICENSE' 2026-04-13T19:41:18,442 writing manifest file '/tmp/pip-modern-metadata-k2xqe86g/acellera_htmd.egg-info/SOURCES.txt' 2026-04-13T19:41:18,444 creating '/tmp/pip-modern-metadata-k2xqe86g/acellera_htmd-2.6.1.dist-info' 2026-04-13T19:41:18,578 Preparing metadata (pyproject.toml): finished with status 'done' 2026-04-13T19:41:18,583 Source in /tmp/pip-wheel-0ya4hjmy/acellera-htmd_12beaa1db3ba481bae7976b7311ec507 has version 2.6.1, which satisfies requirement acellera-htmd==2.6.1 from https://files.pythonhosted.org/packages/c3/49/1143b30c950f6e2e2af252e852d5ebdb7e85bed42e351f8250032daed81f/acellera_htmd-2.6.1.tar.gz 2026-04-13T19:41:18,583 Removed acellera-htmd==2.6.1 from https://files.pythonhosted.org/packages/c3/49/1143b30c950f6e2e2af252e852d5ebdb7e85bed42e351f8250032daed81f/acellera_htmd-2.6.1.tar.gz from build tracker '/tmp/pip-build-tracker-ukom60w8' 2026-04-13T19:41:18,589 Created temporary directory: /tmp/pip-unpack-xjboyw2r 2026-04-13T19:41:18,590 Building wheels for collected packages: acellera-htmd 2026-04-13T19:41:18,594 Created temporary directory: /tmp/pip-wheel-4izgf5jr 2026-04-13T19:41:18,594 Destination directory: /tmp/pip-wheel-4izgf5jr 2026-04-13T19:41:18,596 Building wheel for acellera-htmd (pyproject.toml): started 2026-04-13T19:41:18,598 Running command Building wheel for acellera-htmd (pyproject.toml) 2026-04-13T19:41:19,334 running bdist_wheel 2026-04-13T19:41:19,359 running build 2026-04-13T19:41:19,359 running build_py 2026-04-13T19:41:19,361 creating build/lib/htmd 2026-04-13T19:41:19,363 copying htmd/session.py -> build/lib/htmd 2026-04-13T19:41:19,366 copying htmd/metricdatagenerator.py -> build/lib/htmd 2026-04-13T19:41:19,368 copying htmd/pathplanning.py -> build/lib/htmd 2026-04-13T19:41:19,371 copying htmd/license.py -> build/lib/htmd 2026-04-13T19:41:19,373 copying htmd/util.py -> build/lib/htmd 2026-04-13T19:41:19,375 copying htmd/simlist.py -> build/lib/htmd 2026-04-13T19:41:19,378 copying htmd/model.py -> build/lib/htmd 2026-04-13T19:41:19,381 copying htmd/units.py -> build/lib/htmd 2026-04-13T19:41:19,383 copying htmd/ui.py -> build/lib/htmd 2026-04-13T19:41:19,385 copying htmd/latest.py -> build/lib/htmd 2026-04-13T19:41:19,387 copying htmd/versionwarnings.py -> build/lib/htmd 2026-04-13T19:41:19,389 copying htmd/home.py -> build/lib/htmd 2026-04-13T19:41:19,391 copying htmd/decorators.py -> build/lib/htmd 2026-04-13T19:41:19,393 copying htmd/config.py -> build/lib/htmd 2026-04-13T19:41:19,395 copying htmd/parallelprogress.py -> build/lib/htmd 2026-04-13T19:41:19,396 copying htmd/dock.py -> build/lib/htmd 2026-04-13T19:41:19,399 copying htmd/metricdata.py -> build/lib/htmd 2026-04-13T19:41:19,402 copying htmd/__init__.py -> build/lib/htmd 2026-04-13T19:41:19,404 copying htmd/kinetics.py -> build/lib/htmd 2026-04-13T19:41:19,406 copying htmd/mutualinformation.py -> build/lib/htmd 2026-04-13T19:41:19,409 creating build/lib/htmd/builder 2026-04-13T19:41:19,410 copying htmd/builder/loopmodeler.py -> build/lib/htmd/builder 2026-04-13T19:41:19,413 copying htmd/builder/builder.py -> build/lib/htmd/builder 2026-04-13T19:41:19,415 copying htmd/builder/solvate.py -> build/lib/htmd/builder 2026-04-13T19:41:19,418 copying htmd/builder/charmm.py -> build/lib/htmd/builder 2026-04-13T19:41:19,421 copying htmd/builder/amber.py -> build/lib/htmd/builder 2026-04-13T19:41:19,424 copying htmd/builder/noncanonical.py -> build/lib/htmd/builder 2026-04-13T19:41:19,427 copying htmd/builder/ionize.py -> build/lib/htmd/builder 2026-04-13T19:41:19,429 copying htmd/builder/__init__.py -> build/lib/htmd/builder 2026-04-13T19:41:19,432 creating build/lib/htmd/membranebuilder 2026-04-13T19:41:19,433 copying htmd/membranebuilder/build_membrane.py -> build/lib/htmd/membranebuilder 2026-04-13T19:41:19,435 copying htmd/membranebuilder/ljfluid.py -> build/lib/htmd/membranebuilder 2026-04-13T19:41:19,437 copying htmd/membranebuilder/globalminimization.py -> build/lib/htmd/membranebuilder 2026-04-13T19:41:19,439 copying htmd/membranebuilder/__init__.py -> build/lib/htmd/membranebuilder 2026-04-13T19:41:19,441 copying htmd/membranebuilder/ringpenetration.py -> build/lib/htmd/membranebuilder 2026-04-13T19:41:19,444 creating build/lib/htmd/projections 2026-04-13T19:41:19,444 copying htmd/projections/tica.py -> build/lib/htmd/projections 2026-04-13T19:41:19,447 copying htmd/projections/gwpca.py -> build/lib/htmd/projections 2026-04-13T19:41:19,449 copying htmd/projections/kmeanstri.py -> build/lib/htmd/projections 2026-04-13T19:41:19,451 copying htmd/projections/metric.py -> build/lib/htmd/projections 2026-04-13T19:41:19,453 copying htmd/projections/__init__.py -> build/lib/htmd/projections 2026-04-13T19:41:19,455 creating build/lib/htmd/clustering 2026-04-13T19:41:19,456 copying htmd/clustering/kcenters.py -> build/lib/htmd/clustering 2026-04-13T19:41:19,459 copying htmd/clustering/regular.py -> build/lib/htmd/clustering 2026-04-13T19:41:19,461 copying htmd/clustering/__init__.py -> build/lib/htmd/clustering 2026-04-13T19:41:19,463 creating build/lib/htmd/adaptive 2026-04-13T19:41:19,464 copying htmd/adaptive/util.py -> build/lib/htmd/adaptive 2026-04-13T19:41:19,466 copying htmd/adaptive/adaptiverun.py -> build/lib/htmd/adaptive 2026-04-13T19:41:19,468 copying htmd/adaptive/adaptivegoaleg.py -> build/lib/htmd/adaptive 2026-04-13T19:41:19,471 copying htmd/adaptive/adaptive.py -> build/lib/htmd/adaptive 2026-04-13T19:41:19,474 copying htmd/adaptive/adaptivegoal.py -> build/lib/htmd/adaptive 2026-04-13T19:41:19,476 copying htmd/adaptive/adaptivebandit.py -> build/lib/htmd/adaptive 2026-04-13T19:41:19,479 copying htmd/adaptive/__init__.py -> build/lib/htmd/adaptive 2026-04-13T19:41:19,514 creating build/lib/htmd/share 2026-04-13T19:41:19,515 copying htmd/share/license-checker -> build/lib/htmd/share 2026-04-13T19:41:19,522 creating build/lib/htmd/share/builder 2026-04-13T19:41:19,523 copying htmd/share/builder/triala_capped.mmtf -> build/lib/htmd/share/builder 2026-04-13T19:41:19,525 copying htmd/share/builder/triala_capped.cif -> build/lib/htmd/share/builder 2026-04-13T19:41:19,528 copying htmd/share/builder/charmmlipid2amber.csv -> build/lib/htmd/share/builder 2026-04-13T19:41:19,535 creating build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,537 copying htmd/share/builder/amberfiles/ff-ncaa/README.txt -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,539 copying htmd/share/builder/amberfiles/ff-ncaa/BB8.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,541 copying htmd/share/builder/amberfiles/ff-ncaa/AHP.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,543 copying htmd/share/builder/amberfiles/ff-ncaa/ME0.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,545 copying htmd/share/builder/amberfiles/ff-ncaa/MME.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,548 copying htmd/share/builder/amberfiles/ff-ncaa/BB8.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,550 copying htmd/share/builder/amberfiles/ff-ncaa/4IN.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,552 copying htmd/share/builder/amberfiles/ff-ncaa/ALC.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,554 copying htmd/share/builder/amberfiles/ff-ncaa/HTR.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,556 copying htmd/share/builder/amberfiles/ff-ncaa/GME.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,558 copying htmd/share/builder/amberfiles/ff-ncaa/4PH.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,561 copying htmd/share/builder/amberfiles/ff-ncaa/NZC.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,563 copying htmd/share/builder/amberfiles/ff-ncaa/OMX.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,565 copying htmd/share/builder/amberfiles/ff-ncaa/APD.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,567 copying htmd/share/builder/amberfiles/ff-ncaa/IML.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,569 copying htmd/share/builder/amberfiles/ff-ncaa/GME.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,571 copying htmd/share/builder/amberfiles/ff-ncaa/MEN.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,573 copying htmd/share/builder/amberfiles/ff-ncaa/MEQ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,575 copying htmd/share/builder/amberfiles/ff-ncaa/GNC.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,577 copying htmd/share/builder/amberfiles/ff-ncaa/IGL.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,579 copying htmd/share/builder/amberfiles/ff-ncaa/OCY.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,581 copying htmd/share/builder/amberfiles/ff-ncaa/CSA.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,583 copying htmd/share/builder/amberfiles/ff-ncaa/CCS.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,586 copying htmd/share/builder/amberfiles/ff-ncaa/TY2.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,588 copying htmd/share/builder/amberfiles/ff-ncaa/HLU.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,590 copying htmd/share/builder/amberfiles/ff-ncaa/LMQ.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,592 copying htmd/share/builder/amberfiles/ff-ncaa/NAL.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,595 copying htmd/share/builder/amberfiles/ff-ncaa/OMX.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,597 copying htmd/share/builder/amberfiles/ff-ncaa/BCS.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,599 copying htmd/share/builder/amberfiles/ff-ncaa/I2M.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,601 copying htmd/share/builder/amberfiles/ff-ncaa/TY2.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,604 copying htmd/share/builder/amberfiles/ff-ncaa/NCY.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,606 copying htmd/share/builder/amberfiles/ff-ncaa/DPP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,608 copying htmd/share/builder/amberfiles/ff-ncaa/TYQ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,610 copying htmd/share/builder/amberfiles/ff-ncaa/HLX.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,613 copying htmd/share/builder/amberfiles/ff-ncaa/YNM.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,615 copying htmd/share/builder/amberfiles/ff-ncaa/D4P.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,617 copying htmd/share/builder/amberfiles/ff-ncaa/ABA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,620 copying htmd/share/builder/amberfiles/ff-ncaa/YNM.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,622 copying htmd/share/builder/amberfiles/ff-ncaa/03Y.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,624 copying htmd/share/builder/amberfiles/ff-ncaa/0BN.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,627 copying htmd/share/builder/amberfiles/ff-ncaa/NAL.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,631 copying htmd/share/builder/amberfiles/ff-ncaa/ONL.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,633 copying htmd/share/builder/amberfiles/ff-ncaa/2GX.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,635 copying htmd/share/builder/amberfiles/ff-ncaa/MEQ.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,638 copying htmd/share/builder/amberfiles/ff-ncaa/AA4.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,640 copying htmd/share/builder/amberfiles/ff-ncaa/MEA.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,642 copying htmd/share/builder/amberfiles/ff-ncaa/IML.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,644 copying htmd/share/builder/amberfiles/ff-ncaa/ONL.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,647 copying htmd/share/builder/amberfiles/ff-ncaa/ffncaa.in -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,651 copying htmd/share/builder/amberfiles/ff-ncaa/HQA.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,654 copying htmd/share/builder/amberfiles/ff-ncaa/2AS.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,656 copying htmd/share/builder/amberfiles/ff-ncaa/MLZ.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,658 copying htmd/share/builder/amberfiles/ff-ncaa/03Y.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,660 copying htmd/share/builder/amberfiles/ff-ncaa/APD.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,663 copying htmd/share/builder/amberfiles/ff-ncaa/HTR.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,665 copying htmd/share/builder/amberfiles/ff-ncaa/MVA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,667 copying htmd/share/builder/amberfiles/ff-ncaa/2ML.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,670 copying htmd/share/builder/amberfiles/ff-ncaa/2ML.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,672 copying htmd/share/builder/amberfiles/ff-ncaa/004.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,674 copying htmd/share/builder/amberfiles/ff-ncaa/HPE.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,676 copying htmd/share/builder/amberfiles/ff-ncaa/MMO.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,679 copying htmd/share/builder/amberfiles/ff-ncaa/0A1.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,681 copying htmd/share/builder/amberfiles/ff-ncaa/FGL.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,683 copying htmd/share/builder/amberfiles/ff-ncaa/DAB.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,686 copying htmd/share/builder/amberfiles/ff-ncaa/LME.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,688 copying htmd/share/builder/amberfiles/ff-ncaa/NZC.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,690 copying htmd/share/builder/amberfiles/ff-ncaa/004.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,693 copying htmd/share/builder/amberfiles/ff-ncaa/IIL.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,695 copying htmd/share/builder/amberfiles/ff-ncaa/NCY.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,697 copying htmd/share/builder/amberfiles/ff-ncaa/ESC.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,700 copying htmd/share/builder/amberfiles/ff-ncaa/DPP.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,702 copying htmd/share/builder/amberfiles/ff-ncaa/HHK.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,704 copying htmd/share/builder/amberfiles/ff-ncaa/MLZ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,707 copying htmd/share/builder/amberfiles/ff-ncaa/NVA.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,709 copying htmd/share/builder/amberfiles/ff-ncaa/NLE.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,711 copying htmd/share/builder/amberfiles/ff-ncaa/CSA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,713 copying htmd/share/builder/amberfiles/ff-ncaa/MME.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,715 copying htmd/share/builder/amberfiles/ff-ncaa/AA4.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,717 copying htmd/share/builder/amberfiles/ff-ncaa/HHK.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,720 copying htmd/share/builder/amberfiles/ff-ncaa/YCM.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,722 copying htmd/share/builder/amberfiles/ff-ncaa/KYN.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,725 copying htmd/share/builder/amberfiles/ff-ncaa/1MH.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,727 copying htmd/share/builder/amberfiles/ff-ncaa/HLU.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,729 copying htmd/share/builder/amberfiles/ff-ncaa/0A1.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,732 copying htmd/share/builder/amberfiles/ff-ncaa/KYN.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,734 copying htmd/share/builder/amberfiles/ff-ncaa/LMQ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,737 copying htmd/share/builder/amberfiles/ff-ncaa/IIL.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,739 copying htmd/share/builder/amberfiles/ff-ncaa/2GX.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,742 copying htmd/share/builder/amberfiles/ff-ncaa/HPE.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,745 copying htmd/share/builder/amberfiles/ff-ncaa/MVA.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,747 copying htmd/share/builder/amberfiles/ff-ncaa/ME0.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,749 copying htmd/share/builder/amberfiles/ff-ncaa/D4P.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,752 copying htmd/share/builder/amberfiles/ff-ncaa/MLE.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,754 copying htmd/share/builder/amberfiles/ff-ncaa/ABA.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,756 copying htmd/share/builder/amberfiles/ff-ncaa/4IN.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,758 copying htmd/share/builder/amberfiles/ff-ncaa/GHG.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,760 copying htmd/share/builder/amberfiles/ff-ncaa/GNC.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,763 copying htmd/share/builder/amberfiles/ff-ncaa/CCS.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,765 copying htmd/share/builder/amberfiles/ff-ncaa/0BN.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,767 copying htmd/share/builder/amberfiles/ff-ncaa/AHP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,770 copying htmd/share/builder/amberfiles/ff-ncaa/MEA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,772 copying htmd/share/builder/amberfiles/ff-ncaa/5JP.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,774 copying htmd/share/builder/amberfiles/ff-ncaa/ALC.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,777 copying htmd/share/builder/amberfiles/ff-ncaa/ALN.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,779 copying htmd/share/builder/amberfiles/ff-ncaa/I2M.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,781 copying htmd/share/builder/amberfiles/ff-ncaa/YCM.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,783 copying htmd/share/builder/amberfiles/ff-ncaa/MEN.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,785 copying htmd/share/builder/amberfiles/ff-ncaa/2AS.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,787 copying htmd/share/builder/amberfiles/ff-ncaa/OCY.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,789 copying htmd/share/builder/amberfiles/ff-ncaa/HOX.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,792 copying htmd/share/builder/amberfiles/ff-ncaa/TYQ.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,794 copying htmd/share/builder/amberfiles/ff-ncaa/MLE.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,796 copying htmd/share/builder/amberfiles/ff-ncaa/BCS.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,798 copying htmd/share/builder/amberfiles/ff-ncaa/NVA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,800 copying htmd/share/builder/amberfiles/ff-ncaa/ESC.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,803 copying htmd/share/builder/amberfiles/ff-ncaa/TRO.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,806 copying htmd/share/builder/amberfiles/ff-ncaa/GHG.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,808 copying htmd/share/builder/amberfiles/ff-ncaa/DAB.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,810 copying htmd/share/builder/amberfiles/ff-ncaa/TRO.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,813 copying htmd/share/builder/amberfiles/ff-ncaa/MMO.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,815 copying htmd/share/builder/amberfiles/ff-ncaa/4PH.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,817 copying htmd/share/builder/amberfiles/ff-ncaa/5JP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,819 copying htmd/share/builder/amberfiles/ff-ncaa/ALN.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,821 copying htmd/share/builder/amberfiles/ff-ncaa/1MH.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,824 copying htmd/share/builder/amberfiles/ff-ncaa/LME.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,826 copying htmd/share/builder/amberfiles/ff-ncaa/HOX.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,828 copying htmd/share/builder/amberfiles/ff-ncaa/HQA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,830 copying htmd/share/builder/amberfiles/ff-ncaa/IGL.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,833 copying htmd/share/builder/amberfiles/ff-ncaa/FGL.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,835 copying htmd/share/builder/amberfiles/ff-ncaa/HLX.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,837 copying htmd/share/builder/amberfiles/ff-ncaa/NLE.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:19,840 creating build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,841 copying htmd/share/builder/amberfiles/cofactors/README.txt -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,843 copying htmd/share/builder/amberfiles/cofactors/ATP.prepi -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,846 copying htmd/share/builder/amberfiles/cofactors/cofactors.in -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,849 copying htmd/share/builder/amberfiles/cofactors/GTP.prepi -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,851 copying htmd/share/builder/amberfiles/cofactors/NAI.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,853 copying htmd/share/builder/amberfiles/cofactors/GDP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,855 copying htmd/share/builder/amberfiles/cofactors/HEM.prepi -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,858 copying htmd/share/builder/amberfiles/cofactors/NAD.prepi -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,860 copying htmd/share/builder/amberfiles/cofactors/ADP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,862 copying htmd/share/builder/amberfiles/cofactors/NAP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,865 copying htmd/share/builder/amberfiles/cofactors/AMP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,867 copying htmd/share/builder/amberfiles/cofactors/FMN.prepi -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,869 copying htmd/share/builder/amberfiles/cofactors/GTP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,872 copying htmd/share/builder/amberfiles/cofactors/NAI.prepi -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,874 copying htmd/share/builder/amberfiles/cofactors/NAP.prepi -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,877 copying htmd/share/builder/amberfiles/cofactors/HEM.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,879 copying htmd/share/builder/amberfiles/cofactors/NAD.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,881 copying htmd/share/builder/amberfiles/cofactors/FMN.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,883 copying htmd/share/builder/amberfiles/cofactors/GDP.prepi -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,885 copying htmd/share/builder/amberfiles/cofactors/AMP.prepi -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,888 copying htmd/share/builder/amberfiles/cofactors/ATP.frcmod -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,890 copying htmd/share/builder/amberfiles/cofactors/ADP.prepi -> build/lib/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:19,892 creating build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,893 copying htmd/share/builder/amberfiles/ff-ptm/README.txt -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,896 copying htmd/share/builder/amberfiles/ff-ptm/DA2.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,898 copying htmd/share/builder/amberfiles/ff-ptm/PTR.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,901 copying htmd/share/builder/amberfiles/ff-ptm/CSO.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,903 copying htmd/share/builder/amberfiles/ff-ptm/LYZ.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,906 copying htmd/share/builder/amberfiles/ff-ptm/SEP.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,908 copying htmd/share/builder/amberfiles/ff-ptm/BTK.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,911 copying htmd/share/builder/amberfiles/ff-ptm/DAH.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,913 copying htmd/share/builder/amberfiles/ff-ptm/HYP.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,916 copying htmd/share/builder/amberfiles/ff-ptm/HY3.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,918 copying htmd/share/builder/amberfiles/ff-ptm/PCA.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,920 copying htmd/share/builder/amberfiles/ff-ptm/SEP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,922 copying htmd/share/builder/amberfiles/ff-ptm/HY3.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,924 copying htmd/share/builder/amberfiles/ff-ptm/HYP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,927 copying htmd/share/builder/amberfiles/ff-ptm/M3L.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,929 copying htmd/share/builder/amberfiles/ff-ptm/DAH.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,931 copying htmd/share/builder/amberfiles/ff-ptm/CGU.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,933 copying htmd/share/builder/amberfiles/ff-ptm/BTK.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,935 copying htmd/share/builder/amberfiles/ff-ptm/P1L.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,937 copying htmd/share/builder/amberfiles/ff-ptm/4PQ.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,939 copying htmd/share/builder/amberfiles/ff-ptm/ffptm.in -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,943 copying htmd/share/builder/amberfiles/ff-ptm/0AF.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,945 copying htmd/share/builder/amberfiles/ff-ptm/LYZ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,947 copying htmd/share/builder/amberfiles/ff-ptm/MLY.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,949 copying htmd/share/builder/amberfiles/ff-ptm/DA2.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,951 copying htmd/share/builder/amberfiles/ff-ptm/ORM.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,954 copying htmd/share/builder/amberfiles/ff-ptm/PTR.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,956 copying htmd/share/builder/amberfiles/ff-ptm/2MR.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,958 copying htmd/share/builder/amberfiles/ff-ptm/PRK.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,960 copying htmd/share/builder/amberfiles/ff-ptm/TPO.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,962 copying htmd/share/builder/amberfiles/ff-ptm/CSS.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,964 copying htmd/share/builder/amberfiles/ff-ptm/0AF.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,966 copying htmd/share/builder/amberfiles/ff-ptm/ALY.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,969 copying htmd/share/builder/amberfiles/ff-ptm/2MR.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,971 copying htmd/share/builder/amberfiles/ff-ptm/TPO.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,973 copying htmd/share/builder/amberfiles/ff-ptm/MLY.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,975 copying htmd/share/builder/amberfiles/ff-ptm/ALY.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,977 copying htmd/share/builder/amberfiles/ff-ptm/CSO.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,979 copying htmd/share/builder/amberfiles/ff-ptm/P1L.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,982 copying htmd/share/builder/amberfiles/ff-ptm/CGU.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,984 copying htmd/share/builder/amberfiles/ff-ptm/PRK.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,986 copying htmd/share/builder/amberfiles/ff-ptm/4PQ.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,988 copying htmd/share/builder/amberfiles/ff-ptm/M3L.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,990 copying htmd/share/builder/amberfiles/ff-ptm/CSP.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,992 copying htmd/share/builder/amberfiles/ff-ptm/CSS.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,994 copying htmd/share/builder/amberfiles/ff-ptm/ORM.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,996 copying htmd/share/builder/amberfiles/ff-ptm/PCA.prepi -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:19,998 copying htmd/share/builder/amberfiles/ff-ptm/CSP.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:20,000 creating build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2026-04-13T19:41:20,001 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/README.txt -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2026-04-13T19:41:20,004 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/leap.log -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2026-04-13T19:41:20,006 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/ff-nucleic-OL15.lib -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2026-04-13T19:41:20,010 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/ff-nucleic-OL15.frcmod -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2026-04-13T19:41:20,013 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/leap-ff-nucleic-OL15.in -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2026-04-13T19:41:20,015 copying htmd/share/builder/amberfiles/ff-nucleic-OL15/leaprc.ff-nucleic-OL15 -> build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15 2026-04-13T19:41:20,017 creating build/lib/htmd/share/builder/caps 2026-04-13T19:41:20,018 copying htmd/share/builder/caps/NME.pdb -> build/lib/htmd/share/builder/caps 2026-04-13T19:41:20,020 copying htmd/share/builder/caps/ACE.pdb -> build/lib/htmd/share/builder/caps 2026-04-13T19:41:20,022 copying htmd/share/builder/caps/NHE.pdb -> build/lib/htmd/share/builder/caps 2026-04-13T19:41:20,024 copying htmd/share/builder/caps/NME.cif -> build/lib/htmd/share/builder/caps 2026-04-13T19:41:20,026 copying htmd/share/builder/caps/ACE.cif -> build/lib/htmd/share/builder/caps 2026-04-13T19:41:20,028 creating build/lib/htmd/share/builder/charmmfiles 2026-04-13T19:41:20,029 copying htmd/share/builder/charmmfiles/README.md -> build/lib/htmd/share/builder/charmmfiles 2026-04-13T19:41:20,032 copying htmd/share/builder/charmmfiles/Makefile -> build/lib/htmd/share/builder/charmmfiles 2026-04-13T19:41:20,034 creating build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,035 copying htmd/share/builder/charmmfiles/par/par_all22_prot.prm -> build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,040 copying htmd/share/builder/charmmfiles/par/par_all35_ethers.prm -> build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,043 copying htmd/share/builder/charmmfiles/par/par_all36_lipid_ljpme.prm -> build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,046 copying htmd/share/builder/charmmfiles/par/par_all22star_prot.prm -> build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,052 copying htmd/share/builder/charmmfiles/par/par_all36_cgenff.prm -> build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,074 copying htmd/share/builder/charmmfiles/par/par_all36_na.prm -> build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,078 copying htmd/share/builder/charmmfiles/par/par_all36_carb.prm -> build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,083 copying htmd/share/builder/charmmfiles/par/par_water_ions.prm -> build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,085 copying htmd/share/builder/charmmfiles/par/par_all36_lipid.prm -> build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,089 copying htmd/share/builder/charmmfiles/par/par_all36m_prot.prm -> build/lib/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:20,094 creating build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,095 copying htmd/share/builder/charmmfiles/top/top_all36_lipid_ljpme.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,104 copying htmd/share/builder/charmmfiles/top/top_all36_cgenff.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,183 copying htmd/share/builder/charmmfiles/top/top_all36_lipid.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,195 copying htmd/share/builder/charmmfiles/top/top_all22_prot.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,199 copying htmd/share/builder/charmmfiles/top/top_all22star_prot.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,203 copying htmd/share/builder/charmmfiles/top/top_water_ions.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,205 copying htmd/share/builder/charmmfiles/top/top_all35_ethers.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,208 copying htmd/share/builder/charmmfiles/top/top_all36_na.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,212 copying htmd/share/builder/charmmfiles/top/top_all36_prot.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,217 copying htmd/share/builder/charmmfiles/top/top_all36_carb.rtf -> build/lib/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:20,224 creating build/lib/htmd/share/builder/charmmfiles/str 2026-04-13T19:41:20,225 copying htmd/share/builder/charmmfiles/str/toppar_water_ions.str -> build/lib/htmd/share/builder/charmmfiles/str 2026-04-13T19:41:20,228 creating build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,229 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_modify_res.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,262 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_model.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,266 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_heme_for_new_psf_gen_code_2022.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,269 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_arg0.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,272 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_c36m_d_aminoacids.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,276 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_retinol.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,280 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_na_combined.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,284 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_fluoro_alkanes.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,287 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_pyridines.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,290 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_aldehydes.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,293 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_heme.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,297 copying htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_cofactors.str -> build/lib/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:20,303 creating build/lib/htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:20,304 copying htmd/share/builder/charmmfiles/str/na/toppar_all36_na_rna_modified.str -> build/lib/htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:20,329 copying htmd/share/builder/charmmfiles/str/na/toppar_all36_na_model.str -> build/lib/htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:20,334 copying htmd/share/builder/charmmfiles/str/na/toppar_all36_na_modifications.str -> build/lib/htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:20,340 copying htmd/share/builder/charmmfiles/str/na/toppar_all36_na_reactive_rna.str -> build/lib/htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:20,344 copying htmd/share/builder/charmmfiles/str/na/toppar_all36_na_rna_modified_for_new_psf_gen_code_2022.str -> build/lib/htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:20,363 copying htmd/share/builder/charmmfiles/str/na/toppar_all36_na_nad_ppi.str -> build/lib/htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:20,369 creating build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,370 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_yeast_ljpme.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,374 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_lps.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,413 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_ether_ljpme.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,418 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_miscellaneous_ljpme.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,431 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_miscellaneous.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,454 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_inositol.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,481 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_bacterial.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,489 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_detergent.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,505 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_sphingo.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,513 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_prot.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,516 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_list.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,518 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cationpi_wyf.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,521 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cardiolipin.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,533 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_model.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,538 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cholesterol.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,542 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cholesterol_model_1.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,545 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_bacterial_ljpme.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,552 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_yeast.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,557 copying htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_ether.str -> build/lib/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:20,562 creating build/lib/htmd/share/builder/charmmfiles/str/cphmd 2026-04-13T19:41:20,563 copying htmd/share/builder/charmmfiles/str/cphmd/protpatch_protein_toppar36.str -> build/lib/htmd/share/builder/charmmfiles/str/cphmd 2026-04-13T19:41:20,566 creating build/lib/htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:20,567 copying htmd/share/builder/charmmfiles/str/misc/toppar_hbond.str -> build/lib/htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:20,570 copying htmd/share/builder/charmmfiles/str/misc/toppar_ions_won.str -> build/lib/htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:20,572 copying htmd/share/builder/charmmfiles/str/misc/toppar_dum_noble_gases.str -> build/lib/htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:20,574 copying htmd/share/builder/charmmfiles/str/misc/toppar_cgenff_misc.str -> build/lib/htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:20,577 copying htmd/share/builder/charmmfiles/str/misc/toppar_amines.str -> build/lib/htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:20,580 creating build/lib/htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:20,581 copying htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_glycolipid.str -> build/lib/htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:20,599 copying htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_model.str -> build/lib/htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:20,604 copying htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_imlab.str -> build/lib/htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:20,680 copying htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_glycopeptide.str -> build/lib/htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:20,684 copying htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_lignin.str -> build/lib/htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:20,688 creating build/lib/htmd/share/membranebuilder/lipids 2026-04-13T19:41:20,690 copying htmd/share/membranebuilder/lipids/lipiddb.csv -> build/lib/htmd/share/membranebuilder/lipids 2026-04-13T19:41:20,692 creating build/lib/htmd/share/membranebuilder/lipids/popc 2026-04-13T19:41:20,693 copying htmd/share/membranebuilder/lipids/popc/popc.pdb -> build/lib/htmd/share/membranebuilder/lipids/popc 2026-04-13T19:41:20,696 creating build/lib/htmd/share/membranebuilder/lipids/chl1 2026-04-13T19:41:20,697 copying htmd/share/membranebuilder/lipids/chl1/chl1.pdb -> build/lib/htmd/share/membranebuilder/lipids/chl1 2026-04-13T19:41:20,700 creating build/lib/htmd/share/membranebuilder/lipids/pope 2026-04-13T19:41:20,701 copying htmd/share/membranebuilder/lipids/pope/pope.pdb -> build/lib/htmd/share/membranebuilder/lipids/pope 2026-04-13T19:41:20,704 creating build/lib/htmd/share/solvate 2026-04-13T19:41:20,705 copying htmd/share/solvate/wat.pdb -> build/lib/htmd/share/solvate 2026-04-13T19:41:20,760 installing to build/bdist.linux-armv7l/wheel 2026-04-13T19:41:20,760 running install 2026-04-13T19:41:20,784 running install_lib 2026-04-13T19:41:20,791 creating build/bdist.linux-armv7l/wheel 2026-04-13T19:41:20,794 creating build/bdist.linux-armv7l/wheel/htmd 2026-04-13T19:41:20,795 copying build/lib/htmd/session.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:20,797 copying build/lib/htmd/metricdatagenerator.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:20,799 copying build/lib/htmd/pathplanning.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:20,802 copying build/lib/htmd/license.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:20,804 copying build/lib/htmd/util.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:20,807 creating build/bdist.linux-armv7l/wheel/htmd/builder 2026-04-13T19:41:20,808 copying build/lib/htmd/builder/loopmodeler.py -> build/bdist.linux-armv7l/wheel/./htmd/builder 2026-04-13T19:41:20,811 copying build/lib/htmd/builder/builder.py -> build/bdist.linux-armv7l/wheel/./htmd/builder 2026-04-13T19:41:20,813 copying build/lib/htmd/builder/solvate.py -> build/bdist.linux-armv7l/wheel/./htmd/builder 2026-04-13T19:41:20,816 copying build/lib/htmd/builder/charmm.py -> build/bdist.linux-armv7l/wheel/./htmd/builder 2026-04-13T19:41:20,819 copying build/lib/htmd/builder/amber.py -> build/bdist.linux-armv7l/wheel/./htmd/builder 2026-04-13T19:41:20,822 copying build/lib/htmd/builder/noncanonical.py -> build/bdist.linux-armv7l/wheel/./htmd/builder 2026-04-13T19:41:20,825 copying build/lib/htmd/builder/ionize.py -> build/bdist.linux-armv7l/wheel/./htmd/builder 2026-04-13T19:41:20,827 copying build/lib/htmd/builder/__init__.py -> build/bdist.linux-armv7l/wheel/./htmd/builder 2026-04-13T19:41:20,830 creating build/bdist.linux-armv7l/wheel/htmd/membranebuilder 2026-04-13T19:41:20,831 copying build/lib/htmd/membranebuilder/build_membrane.py -> build/bdist.linux-armv7l/wheel/./htmd/membranebuilder 2026-04-13T19:41:20,834 copying build/lib/htmd/membranebuilder/ljfluid.py -> build/bdist.linux-armv7l/wheel/./htmd/membranebuilder 2026-04-13T19:41:20,836 copying build/lib/htmd/membranebuilder/globalminimization.py -> build/bdist.linux-armv7l/wheel/./htmd/membranebuilder 2026-04-13T19:41:20,838 copying build/lib/htmd/membranebuilder/__init__.py -> build/bdist.linux-armv7l/wheel/./htmd/membranebuilder 2026-04-13T19:41:20,840 copying build/lib/htmd/membranebuilder/ringpenetration.py -> build/bdist.linux-armv7l/wheel/./htmd/membranebuilder 2026-04-13T19:41:20,842 copying build/lib/htmd/simlist.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:20,845 copying build/lib/htmd/model.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:20,848 copying build/lib/htmd/units.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:20,850 creating build/bdist.linux-armv7l/wheel/htmd/projections 2026-04-13T19:41:20,852 copying build/lib/htmd/projections/tica.py -> build/bdist.linux-armv7l/wheel/./htmd/projections 2026-04-13T19:41:20,854 copying build/lib/htmd/projections/gwpca.py -> build/bdist.linux-armv7l/wheel/./htmd/projections 2026-04-13T19:41:20,856 copying build/lib/htmd/projections/kmeanstri.py -> build/bdist.linux-armv7l/wheel/./htmd/projections 2026-04-13T19:41:20,858 copying build/lib/htmd/projections/metric.py -> build/bdist.linux-armv7l/wheel/./htmd/projections 2026-04-13T19:41:20,861 copying build/lib/htmd/projections/__init__.py -> build/bdist.linux-armv7l/wheel/./htmd/projections 2026-04-13T19:41:20,862 copying build/lib/htmd/ui.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:20,865 creating build/bdist.linux-armv7l/wheel/htmd/share 2026-04-13T19:41:20,866 creating build/bdist.linux-armv7l/wheel/htmd/share/builder 2026-04-13T19:41:20,868 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles 2026-04-13T19:41:20,872 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,873 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/README.txt -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,875 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/BB8.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,876 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/AHP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,878 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ME0.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,880 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MME.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,882 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/BB8.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,884 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/4IN.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,886 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ALC.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,889 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HTR.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,891 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/GME.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,893 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/4PH.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,895 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NZC.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,897 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/OMX.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,900 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/APD.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,902 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/IML.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,904 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/GME.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,907 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MEN.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,909 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MEQ.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,911 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/GNC.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,913 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/IGL.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,915 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/OCY.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,918 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/CSA.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,920 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/CCS.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,923 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/TY2.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,925 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HLU.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,927 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/LMQ.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,930 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NAL.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,932 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/OMX.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,935 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/BCS.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,937 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/I2M.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,939 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/TY2.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,942 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NCY.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,944 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/DPP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,947 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/TYQ.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,949 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HLX.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,951 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/YNM.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,953 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/D4P.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,955 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ABA.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,957 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/YNM.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,960 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/03Y.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,962 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/0BN.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,965 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NAL.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,967 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ONL.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,969 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/2GX.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,971 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MEQ.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,973 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/AA4.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,976 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MEA.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,978 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/IML.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,981 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ONL.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,983 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ffncaa.in -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,987 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HQA.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,989 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/2AS.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,991 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MLZ.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,993 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/03Y.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,995 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/APD.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,997 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HTR.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:20,999 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MVA.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,000 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/2ML.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,002 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/2ML.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,004 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/004.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,005 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HPE.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,007 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MMO.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,009 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/0A1.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,011 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/FGL.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,012 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/DAB.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,014 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/LME.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,016 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NZC.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,018 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/004.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,020 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/IIL.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,022 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NCY.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,024 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ESC.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,025 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/DPP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,027 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HHK.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,029 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MLZ.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,031 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NVA.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,033 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NLE.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,035 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/CSA.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,037 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MME.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,039 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/AA4.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,041 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HHK.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,042 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/YCM.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,044 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/KYN.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,046 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/1MH.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,048 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HLU.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,050 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/0A1.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,052 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/KYN.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,054 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/LMQ.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,055 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/IIL.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,057 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/2GX.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,059 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HPE.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,061 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MVA.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,062 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ME0.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,064 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/D4P.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,066 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MLE.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,068 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ABA.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,070 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/4IN.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,071 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/GHG.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,073 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/GNC.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,075 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/CCS.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,077 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/0BN.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,079 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/AHP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,081 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MEA.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,082 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/5JP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,084 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ALC.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,086 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ALN.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,088 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/I2M.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,089 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/YCM.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,091 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MEN.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,093 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/2AS.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,094 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/OCY.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,096 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HOX.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,098 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/TYQ.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,100 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MLE.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,102 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/BCS.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,103 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NVA.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,105 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ESC.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,107 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/TRO.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,109 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/GHG.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,110 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/DAB.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,112 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/TRO.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,114 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/MMO.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,116 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/4PH.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,118 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/5JP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,119 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/ALN.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,121 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/1MH.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,123 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/LME.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,125 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HOX.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,127 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HQA.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,128 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/IGL.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,130 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/FGL.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,132 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/HLX.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,134 copying build/lib/htmd/share/builder/amberfiles/ff-ncaa/NLE.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ncaa 2026-04-13T19:41:21,136 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,137 copying build/lib/htmd/share/builder/amberfiles/cofactors/README.txt -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,139 copying build/lib/htmd/share/builder/amberfiles/cofactors/ATP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,141 copying build/lib/htmd/share/builder/amberfiles/cofactors/cofactors.in -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,144 copying build/lib/htmd/share/builder/amberfiles/cofactors/GTP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,146 copying build/lib/htmd/share/builder/amberfiles/cofactors/NAI.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,147 copying build/lib/htmd/share/builder/amberfiles/cofactors/GDP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,149 copying build/lib/htmd/share/builder/amberfiles/cofactors/HEM.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,151 copying build/lib/htmd/share/builder/amberfiles/cofactors/NAD.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,154 copying build/lib/htmd/share/builder/amberfiles/cofactors/ADP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,156 copying build/lib/htmd/share/builder/amberfiles/cofactors/NAP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,157 copying build/lib/htmd/share/builder/amberfiles/cofactors/AMP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,159 copying build/lib/htmd/share/builder/amberfiles/cofactors/FMN.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,162 copying build/lib/htmd/share/builder/amberfiles/cofactors/GTP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,164 copying build/lib/htmd/share/builder/amberfiles/cofactors/NAI.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,166 copying build/lib/htmd/share/builder/amberfiles/cofactors/NAP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,168 copying build/lib/htmd/share/builder/amberfiles/cofactors/HEM.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,170 copying build/lib/htmd/share/builder/amberfiles/cofactors/NAD.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,172 copying build/lib/htmd/share/builder/amberfiles/cofactors/FMN.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,174 copying build/lib/htmd/share/builder/amberfiles/cofactors/GDP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,176 copying build/lib/htmd/share/builder/amberfiles/cofactors/AMP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,178 copying build/lib/htmd/share/builder/amberfiles/cofactors/ATP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,179 copying build/lib/htmd/share/builder/amberfiles/cofactors/ADP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/cofactors 2026-04-13T19:41:21,182 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,183 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/README.txt -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,185 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/DA2.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,187 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/PTR.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,189 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CSO.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,190 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/LYZ.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,192 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/SEP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,194 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/BTK.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,196 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/DAH.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,197 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/HYP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,199 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/HY3.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,201 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/PCA.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,203 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/SEP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,205 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/HY3.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,207 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/HYP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,209 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/M3L.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,210 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/DAH.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,212 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CGU.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,214 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/BTK.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,216 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/P1L.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,218 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/4PQ.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,220 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/ffptm.in -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,223 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/0AF.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,225 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/LYZ.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,227 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/MLY.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,229 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/DA2.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,231 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/ORM.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,232 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/PTR.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,234 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/2MR.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,236 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/PRK.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,238 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/TPO.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,240 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CSS.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,241 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/0AF.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,243 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/ALY.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,245 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/2MR.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,247 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/TPO.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,249 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/MLY.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,251 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/ALY.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,253 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CSO.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,255 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/P1L.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,258 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CGU.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,260 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/PRK.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,262 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/4PQ.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,263 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/M3L.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,265 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CSP.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,267 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CSS.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,270 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/ORM.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,272 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/PCA.prepi -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,274 copying build/lib/htmd/share/builder/amberfiles/ff-ptm/CSP.frcmod -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-ptm 2026-04-13T19:41:21,277 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/amberfiles/ff-nucleic-OL15 2026-04-13T19:41:21,278 copying build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15/README.txt -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-nucleic-OL15 2026-04-13T19:41:21,280 copying build/lib/htmd/share/builder/amberfiles/ff-nucleic-OL15/leap.log -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/amberfiles/ff-nucleic-OL15 2026-04-13T19:41:21,282 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 2026-04-13T19:41:21,285 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 2026-04-13T19:41:21,288 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 2026-04-13T19:41:21,290 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 2026-04-13T19:41:21,292 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/caps 2026-04-13T19:41:21,293 copying build/lib/htmd/share/builder/caps/NME.pdb -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/caps 2026-04-13T19:41:21,295 copying build/lib/htmd/share/builder/caps/ACE.pdb -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/caps 2026-04-13T19:41:21,297 copying build/lib/htmd/share/builder/caps/NHE.pdb -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/caps 2026-04-13T19:41:21,299 copying build/lib/htmd/share/builder/caps/NME.cif -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/caps 2026-04-13T19:41:21,300 copying build/lib/htmd/share/builder/caps/ACE.cif -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/caps 2026-04-13T19:41:21,302 copying build/lib/htmd/share/builder/triala_capped.mmtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder 2026-04-13T19:41:21,304 copying build/lib/htmd/share/builder/triala_capped.cif -> build/bdist.linux-armv7l/wheel/./htmd/share/builder 2026-04-13T19:41:21,307 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles 2026-04-13T19:41:21,308 copying build/lib/htmd/share/builder/charmmfiles/README.md -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles 2026-04-13T19:41:21,310 copying build/lib/htmd/share/builder/charmmfiles/Makefile -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles 2026-04-13T19:41:21,312 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,313 copying build/lib/htmd/share/builder/charmmfiles/par/par_all22_prot.prm -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,318 copying build/lib/htmd/share/builder/charmmfiles/par/par_all35_ethers.prm -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,320 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36_lipid_ljpme.prm -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,323 copying build/lib/htmd/share/builder/charmmfiles/par/par_all22star_prot.prm -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,328 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36_cgenff.prm -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,350 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36_na.prm -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,354 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36_carb.prm -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,359 copying build/lib/htmd/share/builder/charmmfiles/par/par_water_ions.prm -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,362 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36_lipid.prm -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,365 copying build/lib/htmd/share/builder/charmmfiles/par/par_all36m_prot.prm -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/par 2026-04-13T19:41:21,372 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,373 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_lipid_ljpme.rtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,382 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_cgenff.rtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,420 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_lipid.rtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,433 copying build/lib/htmd/share/builder/charmmfiles/top/top_all22_prot.rtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,436 copying build/lib/htmd/share/builder/charmmfiles/top/top_all22star_prot.rtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,439 copying build/lib/htmd/share/builder/charmmfiles/top/top_water_ions.rtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,441 copying build/lib/htmd/share/builder/charmmfiles/top/top_all35_ethers.rtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,445 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_na.rtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,448 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_prot.rtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,453 copying build/lib/htmd/share/builder/charmmfiles/top/top_all36_carb.rtf -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/top 2026-04-13T19:41:21,461 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/str 2026-04-13T19:41:21,463 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,464 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_modify_res.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,506 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_model.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,510 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_heme_for_new_psf_gen_code_2022.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,513 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_arg0.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,516 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_c36m_d_aminoacids.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,521 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_retinol.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,525 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_na_combined.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,529 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_fluoro_alkanes.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,532 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_pyridines.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,535 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_aldehydes.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,538 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_heme.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,541 copying build/lib/htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_cofactors.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/prot 2026-04-13T19:41:21,547 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:21,548 copying build/lib/htmd/share/builder/charmmfiles/str/na/toppar_all36_na_rna_modified.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:21,568 copying build/lib/htmd/share/builder/charmmfiles/str/na/toppar_all36_na_model.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:21,573 copying build/lib/htmd/share/builder/charmmfiles/str/na/toppar_all36_na_modifications.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:21,579 copying build/lib/htmd/share/builder/charmmfiles/str/na/toppar_all36_na_reactive_rna.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:21,582 copying build/lib/htmd/share/builder/charmmfiles/str/na/toppar_all36_na_rna_modified_for_new_psf_gen_code_2022.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:21,602 copying build/lib/htmd/share/builder/charmmfiles/str/na/toppar_all36_na_nad_ppi.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/na 2026-04-13T19:41:21,609 copying build/lib/htmd/share/builder/charmmfiles/str/toppar_water_ions.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str 2026-04-13T19:41:21,612 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,613 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_yeast_ljpme.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,618 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_lps.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,656 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_ether_ljpme.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,661 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_miscellaneous_ljpme.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,673 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_miscellaneous.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,702 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_inositol.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,739 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_bacterial.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,751 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_detergent.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,776 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_sphingo.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,787 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_prot.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,791 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_list.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,793 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cationpi_wyf.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,794 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cardiolipin.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,807 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_model.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,811 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cholesterol.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,815 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cholesterol_model_1.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,818 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_bacterial_ljpme.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,825 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_yeast.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,830 copying build/lib/htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_ether.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/lipid 2026-04-13T19:41:21,835 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/str/cphmd 2026-04-13T19:41:21,836 copying build/lib/htmd/share/builder/charmmfiles/str/cphmd/protpatch_protein_toppar36.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/cphmd 2026-04-13T19:41:21,839 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:21,840 copying build/lib/htmd/share/builder/charmmfiles/str/misc/toppar_hbond.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:21,842 copying build/lib/htmd/share/builder/charmmfiles/str/misc/toppar_ions_won.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:21,844 copying build/lib/htmd/share/builder/charmmfiles/str/misc/toppar_dum_noble_gases.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:21,846 copying build/lib/htmd/share/builder/charmmfiles/str/misc/toppar_cgenff_misc.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:21,848 copying build/lib/htmd/share/builder/charmmfiles/str/misc/toppar_amines.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/misc 2026-04-13T19:41:21,851 creating build/bdist.linux-armv7l/wheel/htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:21,852 copying build/lib/htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_glycolipid.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:21,870 copying build/lib/htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_model.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:21,874 copying build/lib/htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_imlab.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:21,896 copying build/lib/htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_glycopeptide.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:21,899 copying build/lib/htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_lignin.str -> build/bdist.linux-armv7l/wheel/./htmd/share/builder/charmmfiles/str/carb 2026-04-13T19:41:21,903 copying build/lib/htmd/share/builder/charmmlipid2amber.csv -> build/bdist.linux-armv7l/wheel/./htmd/share/builder 2026-04-13T19:41:21,909 creating build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder 2026-04-13T19:41:21,910 creating build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids 2026-04-13T19:41:21,912 creating build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids/popc 2026-04-13T19:41:21,913 copying build/lib/htmd/share/membranebuilder/lipids/popc/popc.pdb -> build/bdist.linux-armv7l/wheel/./htmd/share/membranebuilder/lipids/popc 2026-04-13T19:41:21,916 creating build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids/chl1 2026-04-13T19:41:21,917 copying build/lib/htmd/share/membranebuilder/lipids/chl1/chl1.pdb -> build/bdist.linux-armv7l/wheel/./htmd/share/membranebuilder/lipids/chl1 2026-04-13T19:41:21,920 creating build/bdist.linux-armv7l/wheel/htmd/share/membranebuilder/lipids/pope 2026-04-13T19:41:21,921 copying build/lib/htmd/share/membranebuilder/lipids/pope/pope.pdb -> build/bdist.linux-armv7l/wheel/./htmd/share/membranebuilder/lipids/pope 2026-04-13T19:41:21,923 copying build/lib/htmd/share/membranebuilder/lipids/lipiddb.csv -> build/bdist.linux-armv7l/wheel/./htmd/share/membranebuilder/lipids 2026-04-13T19:41:21,925 creating build/bdist.linux-armv7l/wheel/htmd/share/solvate 2026-04-13T19:41:21,926 copying build/lib/htmd/share/solvate/wat.pdb -> build/bdist.linux-armv7l/wheel/./htmd/share/solvate 2026-04-13T19:41:21,962 copying build/lib/htmd/share/license-checker -> build/bdist.linux-armv7l/wheel/./htmd/share 2026-04-13T19:41:21,970 creating build/bdist.linux-armv7l/wheel/htmd/clustering 2026-04-13T19:41:21,971 copying build/lib/htmd/clustering/kcenters.py -> build/bdist.linux-armv7l/wheel/./htmd/clustering 2026-04-13T19:41:21,973 copying build/lib/htmd/clustering/regular.py -> build/bdist.linux-armv7l/wheel/./htmd/clustering 2026-04-13T19:41:21,976 copying build/lib/htmd/clustering/__init__.py -> build/bdist.linux-armv7l/wheel/./htmd/clustering 2026-04-13T19:41:21,977 copying build/lib/htmd/latest.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:21,979 copying build/lib/htmd/versionwarnings.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:21,981 copying build/lib/htmd/home.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:21,983 copying build/lib/htmd/decorators.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:21,985 copying build/lib/htmd/config.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:21,987 copying build/lib/htmd/parallelprogress.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:21,989 copying build/lib/htmd/dock.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:21,991 copying build/lib/htmd/metricdata.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:21,994 copying build/lib/htmd/__init__.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:21,996 copying build/lib/htmd/kinetics.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:22,000 creating build/bdist.linux-armv7l/wheel/htmd/adaptive 2026-04-13T19:41:22,001 copying build/lib/htmd/adaptive/util.py -> build/bdist.linux-armv7l/wheel/./htmd/adaptive 2026-04-13T19:41:22,003 copying build/lib/htmd/adaptive/adaptiverun.py -> build/bdist.linux-armv7l/wheel/./htmd/adaptive 2026-04-13T19:41:22,005 copying build/lib/htmd/adaptive/adaptivegoaleg.py -> build/bdist.linux-armv7l/wheel/./htmd/adaptive 2026-04-13T19:41:22,008 copying build/lib/htmd/adaptive/adaptive.py -> build/bdist.linux-armv7l/wheel/./htmd/adaptive 2026-04-13T19:41:22,010 copying build/lib/htmd/adaptive/adaptivegoal.py -> build/bdist.linux-armv7l/wheel/./htmd/adaptive 2026-04-13T19:41:22,013 copying build/lib/htmd/adaptive/adaptivebandit.py -> build/bdist.linux-armv7l/wheel/./htmd/adaptive 2026-04-13T19:41:22,016 copying build/lib/htmd/adaptive/__init__.py -> build/bdist.linux-armv7l/wheel/./htmd/adaptive 2026-04-13T19:41:22,017 copying build/lib/htmd/mutualinformation.py -> build/bdist.linux-armv7l/wheel/./htmd 2026-04-13T19:41:22,020 running install_egg_info 2026-04-13T19:41:22,033 running egg_info 2026-04-13T19:41:22,040 writing acellera_htmd.egg-info/PKG-INFO 2026-04-13T19:41:22,044 writing dependency_links to acellera_htmd.egg-info/dependency_links.txt 2026-04-13T19:41:22,046 writing entry points to acellera_htmd.egg-info/entry_points.txt 2026-04-13T19:41:22,049 writing requirements to acellera_htmd.egg-info/requires.txt 2026-04-13T19:41:22,050 writing top-level names to acellera_htmd.egg-info/top_level.txt 2026-04-13T19:41:22,116 /tmp/pip-build-env-99ze1ijo/overlay/local/lib/python3.11/dist-packages/vcs_versioning/overrides.py:609: UserWarning: No GlobalOverrides context is active. Auto-creating one with SETUPTOOLS_SCM prefix for backwards compatibility. Consider using 'with GlobalOverrides.from_env("YOUR_TOOL"):' explicitly. 2026-04-13T19:41:22,117 return get_active_overrides().subprocess_timeout 2026-04-13T19:41:22,124 listing git files failed - pretending there aren't any 2026-04-13T19:41:22,128 reading manifest file 'acellera_htmd.egg-info/SOURCES.txt' 2026-04-13T19:41:22,148 reading manifest template 'MANIFEST.in' 2026-04-13T19:41:22,166 no previously-included directories found matching 'htmd/data' 2026-04-13T19:41:22,167 no previously-included directories found matching '.github' 2026-04-13T19:41:22,168 no previously-included directories found matching 'doc' 2026-04-13T19:41:22,170 no previously-included directories found matching 'package' 2026-04-13T19:41:22,171 no previously-included directories found matching 'tests' 2026-04-13T19:41:22,172 no previously-included directories found matching 'tutorials' 2026-04-13T19:41:22,173 warning: no previously-included files found matching 'Makefile' 2026-04-13T19:41:22,174 adding license file 'LICENSE' 2026-04-13T19:41:22,195 writing manifest file 'acellera_htmd.egg-info/SOURCES.txt' 2026-04-13T19:41:22,197 Copying acellera_htmd.egg-info to build/bdist.linux-armv7l/wheel/./acellera_htmd-2.6.1-py3.11.egg-info 2026-04-13T19:41:22,209 running install_scripts 2026-04-13T19:41:22,220 creating build/bdist.linux-armv7l/wheel/acellera_htmd-2.6.1.dist-info/WHEEL 2026-04-13T19:41:22,223 creating '/tmp/pip-wheel-4izgf5jr/.tmp-gblvcp3l/acellera_htmd-2.6.1-py3-none-any.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2026-04-13T19:41:22,226 adding 'acellera_htmd-2.6.1.dist-info/licenses/LICENSE' 2026-04-13T19:41:22,229 adding 'htmd/__init__.py' 2026-04-13T19:41:22,230 adding 'htmd/config.py' 2026-04-13T19:41:22,232 adding 'htmd/decorators.py' 2026-04-13T19:41:22,233 adding 'htmd/dock.py' 2026-04-13T19:41:22,235 adding 'htmd/home.py' 2026-04-13T19:41:22,238 adding 'htmd/kinetics.py' 2026-04-13T19:41:22,239 adding 'htmd/latest.py' 2026-04-13T19:41:22,241 adding 'htmd/license.py' 2026-04-13T19:41:22,248 adding 'htmd/metricdata.py' 2026-04-13T19:41:22,250 adding 'htmd/metricdatagenerator.py' 2026-04-13T19:41:22,258 adding 'htmd/model.py' 2026-04-13T19:41:22,261 adding 'htmd/mutualinformation.py' 2026-04-13T19:41:22,262 adding 'htmd/parallelprogress.py' 2026-04-13T19:41:22,265 adding 'htmd/pathplanning.py' 2026-04-13T19:41:22,266 adding 'htmd/session.py' 2026-04-13T19:41:22,269 adding 'htmd/simlist.py' 2026-04-13T19:41:22,271 adding 'htmd/ui.py' 2026-04-13T19:41:22,272 adding 'htmd/units.py' 2026-04-13T19:41:22,274 adding 'htmd/util.py' 2026-04-13T19:41:22,275 adding 'htmd/versionwarnings.py' 2026-04-13T19:41:22,277 adding 'htmd/adaptive/__init__.py' 2026-04-13T19:41:22,279 adding 'htmd/adaptive/adaptive.py' 2026-04-13T19:41:22,283 adding 'htmd/adaptive/adaptivebandit.py' 2026-04-13T19:41:22,286 adding 'htmd/adaptive/adaptivegoal.py' 2026-04-13T19:41:22,288 adding 'htmd/adaptive/adaptivegoaleg.py' 2026-04-13T19:41:22,291 adding 'htmd/adaptive/adaptiverun.py' 2026-04-13T19:41:22,292 adding 'htmd/adaptive/util.py' 2026-04-13T19:41:22,294 adding 'htmd/builder/__init__.py' 2026-04-13T19:41:22,302 adding 'htmd/builder/amber.py' 2026-04-13T19:41:22,305 adding 'htmd/builder/builder.py' 2026-04-13T19:41:22,310 adding 'htmd/builder/charmm.py' 2026-04-13T19:41:22,313 adding 'htmd/builder/ionize.py' 2026-04-13T19:41:22,314 adding 'htmd/builder/loopmodeler.py' 2026-04-13T19:41:22,317 adding 'htmd/builder/noncanonical.py' 2026-04-13T19:41:22,319 adding 'htmd/builder/solvate.py' 2026-04-13T19:41:22,321 adding 'htmd/clustering/__init__.py' 2026-04-13T19:41:22,322 adding 'htmd/clustering/kcenters.py' 2026-04-13T19:41:22,324 adding 'htmd/clustering/regular.py' 2026-04-13T19:41:22,326 adding 'htmd/membranebuilder/__init__.py' 2026-04-13T19:41:22,328 adding 'htmd/membranebuilder/build_membrane.py' 2026-04-13T19:41:22,329 adding 'htmd/membranebuilder/globalminimization.py' 2026-04-13T19:41:22,331 adding 'htmd/membranebuilder/ljfluid.py' 2026-04-13T19:41:22,333 adding 'htmd/membranebuilder/ringpenetration.py' 2026-04-13T19:41:22,334 adding 'htmd/projections/__init__.py' 2026-04-13T19:41:22,336 adding 'htmd/projections/gwpca.py' 2026-04-13T19:41:22,337 adding 'htmd/projections/kmeanstri.py' 2026-04-13T19:41:22,339 adding 'htmd/projections/metric.py' 2026-04-13T19:41:22,341 adding 'htmd/projections/tica.py' 2026-04-13T19:41:22,399 adding 'htmd/share/license-checker' 2026-04-13T19:41:22,431 adding 'htmd/share/builder/charmmlipid2amber.csv' 2026-04-13T19:41:22,434 adding 'htmd/share/builder/triala_capped.cif' 2026-04-13T19:41:22,435 adding 'htmd/share/builder/triala_capped.mmtf' 2026-04-13T19:41:22,438 adding 'htmd/share/builder/amberfiles/cofactors/ADP.frcmod' 2026-04-13T19:41:22,439 adding 'htmd/share/builder/amberfiles/cofactors/ADP.prepi' 2026-04-13T19:41:22,441 adding 'htmd/share/builder/amberfiles/cofactors/AMP.frcmod' 2026-04-13T19:41:22,442 adding 'htmd/share/builder/amberfiles/cofactors/AMP.prepi' 2026-04-13T19:41:22,444 adding 'htmd/share/builder/amberfiles/cofactors/ATP.frcmod' 2026-04-13T19:41:22,445 adding 'htmd/share/builder/amberfiles/cofactors/ATP.prepi' 2026-04-13T19:41:22,446 adding 'htmd/share/builder/amberfiles/cofactors/FMN.frcmod' 2026-04-13T19:41:22,448 adding 'htmd/share/builder/amberfiles/cofactors/FMN.prepi' 2026-04-13T19:41:22,449 adding 'htmd/share/builder/amberfiles/cofactors/GDP.frcmod' 2026-04-13T19:41:22,451 adding 'htmd/share/builder/amberfiles/cofactors/GDP.prepi' 2026-04-13T19:41:22,452 adding 'htmd/share/builder/amberfiles/cofactors/GTP.frcmod' 2026-04-13T19:41:22,454 adding 'htmd/share/builder/amberfiles/cofactors/GTP.prepi' 2026-04-13T19:41:22,455 adding 'htmd/share/builder/amberfiles/cofactors/HEM.frcmod' 2026-04-13T19:41:22,457 adding 'htmd/share/builder/amberfiles/cofactors/HEM.prepi' 2026-04-13T19:41:22,459 adding 'htmd/share/builder/amberfiles/cofactors/NAD.frcmod' 2026-04-13T19:41:22,460 adding 'htmd/share/builder/amberfiles/cofactors/NAD.prepi' 2026-04-13T19:41:22,462 adding 'htmd/share/builder/amberfiles/cofactors/NAI.frcmod' 2026-04-13T19:41:22,464 adding 'htmd/share/builder/amberfiles/cofactors/NAI.prepi' 2026-04-13T19:41:22,465 adding 'htmd/share/builder/amberfiles/cofactors/NAP.frcmod' 2026-04-13T19:41:22,467 adding 'htmd/share/builder/amberfiles/cofactors/NAP.prepi' 2026-04-13T19:41:22,468 adding 'htmd/share/builder/amberfiles/cofactors/README.txt' 2026-04-13T19:41:22,477 adding 'htmd/share/builder/amberfiles/cofactors/cofactors.in' 2026-04-13T19:41:22,481 adding 'htmd/share/builder/amberfiles/ff-ncaa/004.frcmod' 2026-04-13T19:41:22,482 adding 'htmd/share/builder/amberfiles/ff-ncaa/004.prepi' 2026-04-13T19:41:22,484 adding 'htmd/share/builder/amberfiles/ff-ncaa/03Y.frcmod' 2026-04-13T19:41:22,485 adding 'htmd/share/builder/amberfiles/ff-ncaa/03Y.prepi' 2026-04-13T19:41:22,486 adding 'htmd/share/builder/amberfiles/ff-ncaa/0A1.frcmod' 2026-04-13T19:41:22,488 adding 'htmd/share/builder/amberfiles/ff-ncaa/0A1.prepi' 2026-04-13T19:41:22,489 adding 'htmd/share/builder/amberfiles/ff-ncaa/0BN.frcmod' 2026-04-13T19:41:22,490 adding 'htmd/share/builder/amberfiles/ff-ncaa/0BN.prepi' 2026-04-13T19:41:22,491 adding 'htmd/share/builder/amberfiles/ff-ncaa/1MH.frcmod' 2026-04-13T19:41:22,493 adding 'htmd/share/builder/amberfiles/ff-ncaa/1MH.prepi' 2026-04-13T19:41:22,494 adding 'htmd/share/builder/amberfiles/ff-ncaa/2AS.frcmod' 2026-04-13T19:41:22,496 adding 'htmd/share/builder/amberfiles/ff-ncaa/2AS.prepi' 2026-04-13T19:41:22,497 adding 'htmd/share/builder/amberfiles/ff-ncaa/2GX.frcmod' 2026-04-13T19:41:22,498 adding 'htmd/share/builder/amberfiles/ff-ncaa/2GX.prepi' 2026-04-13T19:41:22,499 adding 'htmd/share/builder/amberfiles/ff-ncaa/2ML.frcmod' 2026-04-13T19:41:22,501 adding 'htmd/share/builder/amberfiles/ff-ncaa/2ML.prepi' 2026-04-13T19:41:22,502 adding 'htmd/share/builder/amberfiles/ff-ncaa/4IN.frcmod' 2026-04-13T19:41:22,503 adding 'htmd/share/builder/amberfiles/ff-ncaa/4IN.prepi' 2026-04-13T19:41:22,504 adding 'htmd/share/builder/amberfiles/ff-ncaa/4PH.frcmod' 2026-04-13T19:41:22,506 adding 'htmd/share/builder/amberfiles/ff-ncaa/4PH.prepi' 2026-04-13T19:41:22,507 adding 'htmd/share/builder/amberfiles/ff-ncaa/5JP.frcmod' 2026-04-13T19:41:22,508 adding 'htmd/share/builder/amberfiles/ff-ncaa/5JP.prepi' 2026-04-13T19:41:22,509 adding 'htmd/share/builder/amberfiles/ff-ncaa/AA4.frcmod' 2026-04-13T19:41:22,511 adding 'htmd/share/builder/amberfiles/ff-ncaa/AA4.prepi' 2026-04-13T19:41:22,512 adding 'htmd/share/builder/amberfiles/ff-ncaa/ABA.frcmod' 2026-04-13T19:41:22,513 adding 'htmd/share/builder/amberfiles/ff-ncaa/ABA.prepi' 2026-04-13T19:41:22,514 adding 'htmd/share/builder/amberfiles/ff-ncaa/AHP.frcmod' 2026-04-13T19:41:22,515 adding 'htmd/share/builder/amberfiles/ff-ncaa/AHP.prepi' 2026-04-13T19:41:22,516 adding 'htmd/share/builder/amberfiles/ff-ncaa/ALC.frcmod' 2026-04-13T19:41:22,518 adding 'htmd/share/builder/amberfiles/ff-ncaa/ALC.prepi' 2026-04-13T19:41:22,519 adding 'htmd/share/builder/amberfiles/ff-ncaa/ALN.frcmod' 2026-04-13T19:41:22,520 adding 'htmd/share/builder/amberfiles/ff-ncaa/ALN.prepi' 2026-04-13T19:41:22,522 adding 'htmd/share/builder/amberfiles/ff-ncaa/APD.frcmod' 2026-04-13T19:41:22,523 adding 'htmd/share/builder/amberfiles/ff-ncaa/APD.prepi' 2026-04-13T19:41:22,524 adding 'htmd/share/builder/amberfiles/ff-ncaa/BB8.frcmod' 2026-04-13T19:41:22,526 adding 'htmd/share/builder/amberfiles/ff-ncaa/BB8.prepi' 2026-04-13T19:41:22,527 adding 'htmd/share/builder/amberfiles/ff-ncaa/BCS.frcmod' 2026-04-13T19:41:22,528 adding 'htmd/share/builder/amberfiles/ff-ncaa/BCS.prepi' 2026-04-13T19:41:22,530 adding 'htmd/share/builder/amberfiles/ff-ncaa/CCS.frcmod' 2026-04-13T19:41:22,531 adding 'htmd/share/builder/amberfiles/ff-ncaa/CCS.prepi' 2026-04-13T19:41:22,532 adding 'htmd/share/builder/amberfiles/ff-ncaa/CSA.frcmod' 2026-04-13T19:41:22,534 adding 'htmd/share/builder/amberfiles/ff-ncaa/CSA.prepi' 2026-04-13T19:41:22,535 adding 'htmd/share/builder/amberfiles/ff-ncaa/D4P.frcmod' 2026-04-13T19:41:22,536 adding 'htmd/share/builder/amberfiles/ff-ncaa/D4P.prepi' 2026-04-13T19:41:22,537 adding 'htmd/share/builder/amberfiles/ff-ncaa/DAB.frcmod' 2026-04-13T19:41:22,539 adding 'htmd/share/builder/amberfiles/ff-ncaa/DAB.prepi' 2026-04-13T19:41:22,540 adding 'htmd/share/builder/amberfiles/ff-ncaa/DPP.frcmod' 2026-04-13T19:41:22,541 adding 'htmd/share/builder/amberfiles/ff-ncaa/DPP.prepi' 2026-04-13T19:41:22,542 adding 'htmd/share/builder/amberfiles/ff-ncaa/ESC.frcmod' 2026-04-13T19:41:22,544 adding 'htmd/share/builder/amberfiles/ff-ncaa/ESC.prepi' 2026-04-13T19:41:22,545 adding 'htmd/share/builder/amberfiles/ff-ncaa/FGL.frcmod' 2026-04-13T19:41:22,546 adding 'htmd/share/builder/amberfiles/ff-ncaa/FGL.prepi' 2026-04-13T19:41:22,547 adding 'htmd/share/builder/amberfiles/ff-ncaa/GHG.frcmod' 2026-04-13T19:41:22,549 adding 'htmd/share/builder/amberfiles/ff-ncaa/GHG.prepi' 2026-04-13T19:41:22,550 adding 'htmd/share/builder/amberfiles/ff-ncaa/GME.frcmod' 2026-04-13T19:41:22,551 adding 'htmd/share/builder/amberfiles/ff-ncaa/GME.prepi' 2026-04-13T19:41:22,552 adding 'htmd/share/builder/amberfiles/ff-ncaa/GNC.frcmod' 2026-04-13T19:41:22,554 adding 'htmd/share/builder/amberfiles/ff-ncaa/GNC.prepi' 2026-04-13T19:41:22,555 adding 'htmd/share/builder/amberfiles/ff-ncaa/HHK.frcmod' 2026-04-13T19:41:22,556 adding 'htmd/share/builder/amberfiles/ff-ncaa/HHK.prepi' 2026-04-13T19:41:22,557 adding 'htmd/share/builder/amberfiles/ff-ncaa/HLU.frcmod' 2026-04-13T19:41:22,558 adding 'htmd/share/builder/amberfiles/ff-ncaa/HLU.prepi' 2026-04-13T19:41:22,559 adding 'htmd/share/builder/amberfiles/ff-ncaa/HLX.frcmod' 2026-04-13T19:41:22,561 adding 'htmd/share/builder/amberfiles/ff-ncaa/HLX.prepi' 2026-04-13T19:41:22,562 adding 'htmd/share/builder/amberfiles/ff-ncaa/HOX.frcmod' 2026-04-13T19:41:22,563 adding 'htmd/share/builder/amberfiles/ff-ncaa/HOX.prepi' 2026-04-13T19:41:22,564 adding 'htmd/share/builder/amberfiles/ff-ncaa/HPE.frcmod' 2026-04-13T19:41:22,566 adding 'htmd/share/builder/amberfiles/ff-ncaa/HPE.prepi' 2026-04-13T19:41:22,567 adding 'htmd/share/builder/amberfiles/ff-ncaa/HQA.frcmod' 2026-04-13T19:41:22,568 adding 'htmd/share/builder/amberfiles/ff-ncaa/HQA.prepi' 2026-04-13T19:41:22,569 adding 'htmd/share/builder/amberfiles/ff-ncaa/HTR.frcmod' 2026-04-13T19:41:22,571 adding 'htmd/share/builder/amberfiles/ff-ncaa/HTR.prepi' 2026-04-13T19:41:22,572 adding 'htmd/share/builder/amberfiles/ff-ncaa/I2M.frcmod' 2026-04-13T19:41:22,573 adding 'htmd/share/builder/amberfiles/ff-ncaa/I2M.prepi' 2026-04-13T19:41:22,575 adding 'htmd/share/builder/amberfiles/ff-ncaa/IGL.frcmod' 2026-04-13T19:41:22,576 adding 'htmd/share/builder/amberfiles/ff-ncaa/IGL.prepi' 2026-04-13T19:41:22,577 adding 'htmd/share/builder/amberfiles/ff-ncaa/IIL.frcmod' 2026-04-13T19:41:22,579 adding 'htmd/share/builder/amberfiles/ff-ncaa/IIL.prepi' 2026-04-13T19:41:22,580 adding 'htmd/share/builder/amberfiles/ff-ncaa/IML.frcmod' 2026-04-13T19:41:22,581 adding 'htmd/share/builder/amberfiles/ff-ncaa/IML.prepi' 2026-04-13T19:41:22,582 adding 'htmd/share/builder/amberfiles/ff-ncaa/KYN.frcmod' 2026-04-13T19:41:22,584 adding 'htmd/share/builder/amberfiles/ff-ncaa/KYN.prepi' 2026-04-13T19:41:22,585 adding 'htmd/share/builder/amberfiles/ff-ncaa/LME.frcmod' 2026-04-13T19:41:22,586 adding 'htmd/share/builder/amberfiles/ff-ncaa/LME.prepi' 2026-04-13T19:41:22,587 adding 'htmd/share/builder/amberfiles/ff-ncaa/LMQ.frcmod' 2026-04-13T19:41:22,589 adding 'htmd/share/builder/amberfiles/ff-ncaa/LMQ.prepi' 2026-04-13T19:41:22,590 adding 'htmd/share/builder/amberfiles/ff-ncaa/ME0.frcmod' 2026-04-13T19:41:22,592 adding 'htmd/share/builder/amberfiles/ff-ncaa/ME0.prepi' 2026-04-13T19:41:22,593 adding 'htmd/share/builder/amberfiles/ff-ncaa/MEA.frcmod' 2026-04-13T19:41:22,594 adding 'htmd/share/builder/amberfiles/ff-ncaa/MEA.prepi' 2026-04-13T19:41:22,595 adding 'htmd/share/builder/amberfiles/ff-ncaa/MEN.frcmod' 2026-04-13T19:41:22,597 adding 'htmd/share/builder/amberfiles/ff-ncaa/MEN.prepi' 2026-04-13T19:41:22,598 adding 'htmd/share/builder/amberfiles/ff-ncaa/MEQ.frcmod' 2026-04-13T19:41:22,599 adding 'htmd/share/builder/amberfiles/ff-ncaa/MEQ.prepi' 2026-04-13T19:41:22,601 adding 'htmd/share/builder/amberfiles/ff-ncaa/MLE.frcmod' 2026-04-13T19:41:22,602 adding 'htmd/share/builder/amberfiles/ff-ncaa/MLE.prepi' 2026-04-13T19:41:22,603 adding 'htmd/share/builder/amberfiles/ff-ncaa/MLZ.frcmod' 2026-04-13T19:41:22,605 adding 'htmd/share/builder/amberfiles/ff-ncaa/MLZ.prepi' 2026-04-13T19:41:22,606 adding 'htmd/share/builder/amberfiles/ff-ncaa/MME.frcmod' 2026-04-13T19:41:22,607 adding 'htmd/share/builder/amberfiles/ff-ncaa/MME.prepi' 2026-04-13T19:41:22,608 adding 'htmd/share/builder/amberfiles/ff-ncaa/MMO.frcmod' 2026-04-13T19:41:22,610 adding 'htmd/share/builder/amberfiles/ff-ncaa/MMO.prepi' 2026-04-13T19:41:22,611 adding 'htmd/share/builder/amberfiles/ff-ncaa/MVA.frcmod' 2026-04-13T19:41:22,613 adding 'htmd/share/builder/amberfiles/ff-ncaa/MVA.prepi' 2026-04-13T19:41:22,614 adding 'htmd/share/builder/amberfiles/ff-ncaa/NAL.frcmod' 2026-04-13T19:41:22,616 adding 'htmd/share/builder/amberfiles/ff-ncaa/NAL.prepi' 2026-04-13T19:41:22,617 adding 'htmd/share/builder/amberfiles/ff-ncaa/NCY.frcmod' 2026-04-13T19:41:22,618 adding 'htmd/share/builder/amberfiles/ff-ncaa/NCY.prepi' 2026-04-13T19:41:22,619 adding 'htmd/share/builder/amberfiles/ff-ncaa/NLE.frcmod' 2026-04-13T19:41:22,621 adding 'htmd/share/builder/amberfiles/ff-ncaa/NLE.prepi' 2026-04-13T19:41:22,622 adding 'htmd/share/builder/amberfiles/ff-ncaa/NVA.frcmod' 2026-04-13T19:41:22,623 adding 'htmd/share/builder/amberfiles/ff-ncaa/NVA.prepi' 2026-04-13T19:41:22,624 adding 'htmd/share/builder/amberfiles/ff-ncaa/NZC.frcmod' 2026-04-13T19:41:22,625 adding 'htmd/share/builder/amberfiles/ff-ncaa/NZC.prepi' 2026-04-13T19:41:22,626 adding 'htmd/share/builder/amberfiles/ff-ncaa/OCY.frcmod' 2026-04-13T19:41:22,628 adding 'htmd/share/builder/amberfiles/ff-ncaa/OCY.prepi' 2026-04-13T19:41:22,629 adding 'htmd/share/builder/amberfiles/ff-ncaa/OMX.frcmod' 2026-04-13T19:41:22,630 adding 'htmd/share/builder/amberfiles/ff-ncaa/OMX.prepi' 2026-04-13T19:41:22,632 adding 'htmd/share/builder/amberfiles/ff-ncaa/ONL.frcmod' 2026-04-13T19:41:22,633 adding 'htmd/share/builder/amberfiles/ff-ncaa/ONL.prepi' 2026-04-13T19:41:22,634 adding 'htmd/share/builder/amberfiles/ff-ncaa/README.txt' 2026-04-13T19:41:22,635 adding 'htmd/share/builder/amberfiles/ff-ncaa/TRO.frcmod' 2026-04-13T19:41:22,637 adding 'htmd/share/builder/amberfiles/ff-ncaa/TRO.prepi' 2026-04-13T19:41:22,638 adding 'htmd/share/builder/amberfiles/ff-ncaa/TY2.frcmod' 2026-04-13T19:41:22,640 adding 'htmd/share/builder/amberfiles/ff-ncaa/TY2.prepi' 2026-04-13T19:41:22,641 adding 'htmd/share/builder/amberfiles/ff-ncaa/TYQ.frcmod' 2026-04-13T19:41:22,642 adding 'htmd/share/builder/amberfiles/ff-ncaa/TYQ.prepi' 2026-04-13T19:41:22,644 adding 'htmd/share/builder/amberfiles/ff-ncaa/YCM.frcmod' 2026-04-13T19:41:22,645 adding 'htmd/share/builder/amberfiles/ff-ncaa/YCM.prepi' 2026-04-13T19:41:22,646 adding 'htmd/share/builder/amberfiles/ff-ncaa/YNM.frcmod' 2026-04-13T19:41:22,647 adding 'htmd/share/builder/amberfiles/ff-ncaa/YNM.prepi' 2026-04-13T19:41:22,669 adding 'htmd/share/builder/amberfiles/ff-ncaa/ffncaa.in' 2026-04-13T19:41:22,672 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/README.txt' 2026-04-13T19:41:22,673 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/ff-nucleic-OL15.frcmod' 2026-04-13T19:41:22,678 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/ff-nucleic-OL15.lib' 2026-04-13T19:41:22,680 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/leap-ff-nucleic-OL15.in' 2026-04-13T19:41:22,682 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/leap.log' 2026-04-13T19:41:22,683 adding 'htmd/share/builder/amberfiles/ff-nucleic-OL15/leaprc.ff-nucleic-OL15' 2026-04-13T19:41:22,685 adding 'htmd/share/builder/amberfiles/ff-ptm/0AF.frcmod' 2026-04-13T19:41:22,687 adding 'htmd/share/builder/amberfiles/ff-ptm/0AF.prepi' 2026-04-13T19:41:22,688 adding 'htmd/share/builder/amberfiles/ff-ptm/2MR.frcmod' 2026-04-13T19:41:22,690 adding 'htmd/share/builder/amberfiles/ff-ptm/2MR.prepi' 2026-04-13T19:41:22,691 adding 'htmd/share/builder/amberfiles/ff-ptm/4PQ.frcmod' 2026-04-13T19:41:22,692 adding 'htmd/share/builder/amberfiles/ff-ptm/4PQ.prepi' 2026-04-13T19:41:22,693 adding 'htmd/share/builder/amberfiles/ff-ptm/ALY.frcmod' 2026-04-13T19:41:22,695 adding 'htmd/share/builder/amberfiles/ff-ptm/ALY.prepi' 2026-04-13T19:41:22,696 adding 'htmd/share/builder/amberfiles/ff-ptm/BTK.frcmod' 2026-04-13T19:41:22,698 adding 'htmd/share/builder/amberfiles/ff-ptm/BTK.prepi' 2026-04-13T19:41:22,699 adding 'htmd/share/builder/amberfiles/ff-ptm/CGU.frcmod' 2026-04-13T19:41:22,700 adding 'htmd/share/builder/amberfiles/ff-ptm/CGU.prepi' 2026-04-13T19:41:22,702 adding 'htmd/share/builder/amberfiles/ff-ptm/CSO.frcmod' 2026-04-13T19:41:22,703 adding 'htmd/share/builder/amberfiles/ff-ptm/CSO.prepi' 2026-04-13T19:41:22,705 adding 'htmd/share/builder/amberfiles/ff-ptm/CSP.frcmod' 2026-04-13T19:41:22,706 adding 'htmd/share/builder/amberfiles/ff-ptm/CSP.prepi' 2026-04-13T19:41:22,707 adding 'htmd/share/builder/amberfiles/ff-ptm/CSS.frcmod' 2026-04-13T19:41:22,708 adding 'htmd/share/builder/amberfiles/ff-ptm/CSS.prepi' 2026-04-13T19:41:22,709 adding 'htmd/share/builder/amberfiles/ff-ptm/DA2.frcmod' 2026-04-13T19:41:22,710 adding 'htmd/share/builder/amberfiles/ff-ptm/DA2.prepi' 2026-04-13T19:41:22,711 adding 'htmd/share/builder/amberfiles/ff-ptm/DAH.frcmod' 2026-04-13T19:41:22,713 adding 'htmd/share/builder/amberfiles/ff-ptm/DAH.prepi' 2026-04-13T19:41:22,714 adding 'htmd/share/builder/amberfiles/ff-ptm/HY3.frcmod' 2026-04-13T19:41:22,715 adding 'htmd/share/builder/amberfiles/ff-ptm/HY3.prepi' 2026-04-13T19:41:22,716 adding 'htmd/share/builder/amberfiles/ff-ptm/HYP.frcmod' 2026-04-13T19:41:22,717 adding 'htmd/share/builder/amberfiles/ff-ptm/HYP.prepi' 2026-04-13T19:41:22,718 adding 'htmd/share/builder/amberfiles/ff-ptm/LYZ.frcmod' 2026-04-13T19:41:22,720 adding 'htmd/share/builder/amberfiles/ff-ptm/LYZ.prepi' 2026-04-13T19:41:22,721 adding 'htmd/share/builder/amberfiles/ff-ptm/M3L.frcmod' 2026-04-13T19:41:22,722 adding 'htmd/share/builder/amberfiles/ff-ptm/M3L.prepi' 2026-04-13T19:41:22,724 adding 'htmd/share/builder/amberfiles/ff-ptm/MLY.frcmod' 2026-04-13T19:41:22,725 adding 'htmd/share/builder/amberfiles/ff-ptm/MLY.prepi' 2026-04-13T19:41:22,726 adding 'htmd/share/builder/amberfiles/ff-ptm/ORM.frcmod' 2026-04-13T19:41:22,727 adding 'htmd/share/builder/amberfiles/ff-ptm/ORM.prepi' 2026-04-13T19:41:22,728 adding 'htmd/share/builder/amberfiles/ff-ptm/P1L.frcmod' 2026-04-13T19:41:22,730 adding 'htmd/share/builder/amberfiles/ff-ptm/P1L.prepi' 2026-04-13T19:41:22,731 adding 'htmd/share/builder/amberfiles/ff-ptm/PCA.frcmod' 2026-04-13T19:41:22,732 adding 'htmd/share/builder/amberfiles/ff-ptm/PCA.prepi' 2026-04-13T19:41:22,733 adding 'htmd/share/builder/amberfiles/ff-ptm/PRK.frcmod' 2026-04-13T19:41:22,735 adding 'htmd/share/builder/amberfiles/ff-ptm/PRK.prepi' 2026-04-13T19:41:22,736 adding 'htmd/share/builder/amberfiles/ff-ptm/PTR.frcmod' 2026-04-13T19:41:22,740 adding 'htmd/share/builder/amberfiles/ff-ptm/PTR.prepi' 2026-04-13T19:41:22,741 adding 'htmd/share/builder/amberfiles/ff-ptm/README.txt' 2026-04-13T19:41:22,743 adding 'htmd/share/builder/amberfiles/ff-ptm/SEP.frcmod' 2026-04-13T19:41:22,744 adding 'htmd/share/builder/amberfiles/ff-ptm/SEP.prepi' 2026-04-13T19:41:22,745 adding 'htmd/share/builder/amberfiles/ff-ptm/TPO.frcmod' 2026-04-13T19:41:22,747 adding 'htmd/share/builder/amberfiles/ff-ptm/TPO.prepi' 2026-04-13T19:41:22,755 adding 'htmd/share/builder/amberfiles/ff-ptm/ffptm.in' 2026-04-13T19:41:22,757 adding 'htmd/share/builder/caps/ACE.cif' 2026-04-13T19:41:22,758 adding 'htmd/share/builder/caps/ACE.pdb' 2026-04-13T19:41:22,759 adding 'htmd/share/builder/caps/NHE.pdb' 2026-04-13T19:41:22,761 adding 'htmd/share/builder/caps/NME.cif' 2026-04-13T19:41:22,762 adding 'htmd/share/builder/caps/NME.pdb' 2026-04-13T19:41:22,764 adding 'htmd/share/builder/charmmfiles/Makefile' 2026-04-13T19:41:22,765 adding 'htmd/share/builder/charmmfiles/README.md' 2026-04-13T19:41:22,779 adding 'htmd/share/builder/charmmfiles/par/par_all22_prot.prm' 2026-04-13T19:41:22,794 adding 'htmd/share/builder/charmmfiles/par/par_all22star_prot.prm' 2026-04-13T19:41:22,797 adding 'htmd/share/builder/charmmfiles/par/par_all35_ethers.prm' 2026-04-13T19:41:22,812 adding 'htmd/share/builder/charmmfiles/par/par_all36_carb.prm' 2026-04-13T19:41:22,899 adding 'htmd/share/builder/charmmfiles/par/par_all36_cgenff.prm' 2026-04-13T19:41:22,909 adding 'htmd/share/builder/charmmfiles/par/par_all36_lipid.prm' 2026-04-13T19:41:22,912 adding 'htmd/share/builder/charmmfiles/par/par_all36_lipid_ljpme.prm' 2026-04-13T19:41:22,920 adding 'htmd/share/builder/charmmfiles/par/par_all36_na.prm' 2026-04-13T19:41:22,935 adding 'htmd/share/builder/charmmfiles/par/par_all36m_prot.prm' 2026-04-13T19:41:22,938 adding 'htmd/share/builder/charmmfiles/par/par_water_ions.prm' 2026-04-13T19:41:22,941 adding 'htmd/share/builder/charmmfiles/str/toppar_water_ions.str' 2026-04-13T19:41:23,018 adding 'htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_glycolipid.str' 2026-04-13T19:41:23,028 adding 'htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_glycopeptide.str' 2026-04-13T19:41:23,158 adding 'htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_imlab.str' 2026-04-13T19:41:23,186 adding 'htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_lignin.str' 2026-04-13T19:41:23,198 adding 'htmd/share/builder/charmmfiles/str/carb/toppar_all36_carb_model.str' 2026-04-13T19:41:23,202 adding 'htmd/share/builder/charmmfiles/str/cphmd/protpatch_protein_toppar36.str' 2026-04-13T19:41:23,240 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_bacterial.str' 2026-04-13T19:41:23,272 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_bacterial_ljpme.str' 2026-04-13T19:41:23,379 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cardiolipin.str' 2026-04-13T19:41:23,385 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cationpi_wyf.str' 2026-04-13T19:41:23,398 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cholesterol.str' 2026-04-13T19:41:23,405 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_cholesterol_model_1.str' 2026-04-13T19:41:23,498 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_detergent.str' 2026-04-13T19:41:23,523 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_ether.str' 2026-04-13T19:41:23,543 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_ether_ljpme.str' 2026-04-13T19:41:23,636 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_inositol.str' 2026-04-13T19:41:23,647 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_list.str' 2026-04-13T19:41:23,916 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_lps.str' 2026-04-13T19:41:24,033 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_miscellaneous.str' 2026-04-13T19:41:24,096 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_miscellaneous_ljpme.str' 2026-04-13T19:41:24,112 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_model.str' 2026-04-13T19:41:24,120 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_prot.str' 2026-04-13T19:41:24,137 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_sphingo.str' 2026-04-13T19:41:24,147 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_yeast.str' 2026-04-13T19:41:24,155 adding 'htmd/share/builder/charmmfiles/str/lipid/toppar_all36_lipid_yeast_ljpme.str' 2026-04-13T19:41:24,158 adding 'htmd/share/builder/charmmfiles/str/misc/toppar_amines.str' 2026-04-13T19:41:24,159 adding 'htmd/share/builder/charmmfiles/str/misc/toppar_cgenff_misc.str' 2026-04-13T19:41:24,161 adding 'htmd/share/builder/charmmfiles/str/misc/toppar_dum_noble_gases.str' 2026-04-13T19:41:24,162 adding 'htmd/share/builder/charmmfiles/str/misc/toppar_hbond.str' 2026-04-13T19:41:24,164 adding 'htmd/share/builder/charmmfiles/str/misc/toppar_ions_won.str' 2026-04-13T19:41:24,177 adding 'htmd/share/builder/charmmfiles/str/na/toppar_all36_na_model.str' 2026-04-13T19:41:24,204 adding 'htmd/share/builder/charmmfiles/str/na/toppar_all36_na_modifications.str' 2026-04-13T19:41:24,224 adding 'htmd/share/builder/charmmfiles/str/na/toppar_all36_na_nad_ppi.str' 2026-04-13T19:41:24,230 adding 'htmd/share/builder/charmmfiles/str/na/toppar_all36_na_reactive_rna.str' 2026-04-13T19:41:24,360 adding 'htmd/share/builder/charmmfiles/str/na/toppar_all36_na_rna_modified.str' 2026-04-13T19:41:24,498 adding 'htmd/share/builder/charmmfiles/str/na/toppar_all36_na_rna_modified_for_new_psf_gen_code_2022.str' 2026-04-13T19:41:24,507 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_aldehydes.str' 2026-04-13T19:41:24,510 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_arg0.str' 2026-04-13T19:41:24,522 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_c36m_d_aminoacids.str' 2026-04-13T19:41:24,546 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_cofactors.str' 2026-04-13T19:41:24,549 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_fluoro_alkanes.str' 2026-04-13T19:41:24,552 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_heme.str' 2026-04-13T19:41:24,555 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_heme_for_new_psf_gen_code_2022.str' 2026-04-13T19:41:24,566 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_model.str' 2026-04-13T19:41:24,766 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_modify_res.str' 2026-04-13T19:41:24,787 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_na_combined.str' 2026-04-13T19:41:24,791 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_pyridines.str' 2026-04-13T19:41:24,800 adding 'htmd/share/builder/charmmfiles/str/prot/toppar_all36_prot_retinol.str' 2026-04-13T19:41:24,809 adding 'htmd/share/builder/charmmfiles/top/top_all22_prot.rtf' 2026-04-13T19:41:24,819 adding 'htmd/share/builder/charmmfiles/top/top_all22star_prot.rtf' 2026-04-13T19:41:24,825 adding 'htmd/share/builder/charmmfiles/top/top_all35_ethers.rtf' 2026-04-13T19:41:24,851 adding 'htmd/share/builder/charmmfiles/top/top_all36_carb.rtf' 2026-04-13T19:41:25,159 adding 'htmd/share/builder/charmmfiles/top/top_all36_cgenff.rtf' 2026-04-13T19:41:25,238 adding 'htmd/share/builder/charmmfiles/top/top_all36_lipid.rtf' 2026-04-13T19:41:25,288 adding 'htmd/share/builder/charmmfiles/top/top_all36_lipid_ljpme.rtf' 2026-04-13T19:41:25,295 adding 'htmd/share/builder/charmmfiles/top/top_all36_na.rtf' 2026-04-13T19:41:25,304 adding 'htmd/share/builder/charmmfiles/top/top_all36_prot.rtf' 2026-04-13T19:41:25,306 adding 'htmd/share/builder/charmmfiles/top/top_water_ions.rtf' 2026-04-13T19:41:25,308 adding 'htmd/share/membranebuilder/lipids/lipiddb.csv' 2026-04-13T19:41:25,310 adding 'htmd/share/membranebuilder/lipids/chl1/chl1.pdb' 2026-04-13T19:41:25,312 adding 'htmd/share/membranebuilder/lipids/popc/popc.pdb' 2026-04-13T19:41:25,314 adding 'htmd/share/membranebuilder/lipids/pope/pope.pdb' 2026-04-13T19:41:25,608 adding 'htmd/share/solvate/wat.pdb' 2026-04-13T19:41:25,623 adding 'acellera_htmd-2.6.1.dist-info/METADATA' 2026-04-13T19:41:25,624 adding 'acellera_htmd-2.6.1.dist-info/WHEEL' 2026-04-13T19:41:25,625 adding 'acellera_htmd-2.6.1.dist-info/entry_points.txt' 2026-04-13T19:41:25,626 adding 'acellera_htmd-2.6.1.dist-info/top_level.txt' 2026-04-13T19:41:25,631 adding 'acellera_htmd-2.6.1.dist-info/RECORD' 2026-04-13T19:41:25,678 removing build/bdist.linux-armv7l/wheel 2026-04-13T19:41:25,877 Building wheel for acellera-htmd (pyproject.toml): finished with status 'done' 2026-04-13T19:41:25,972 Created wheel for acellera-htmd: filename=acellera_htmd-2.6.1-py3-none-any.whl size=4270531 sha256=276acfba7f712b652f35f6ce7279fe2885edf66bce30142e45deb90188a58cfb 2026-04-13T19:41:25,973 Stored in directory: /tmp/pip-ephem-wheel-cache-8kyvtmt4/wheels/ab/f6/8d/ef774d833391e6a1cc56e57e4295ab0e05a15980f873754e02 2026-04-13T19:41:25,996 Successfully built acellera-htmd 2026-04-13T19:41:26,101 Removed build tracker: '/tmp/pip-build-tracker-ukom60w8'