2026-09-11T07:53:53,742 Created temporary directory: /tmp/pip-ephem-wheel-cache-got9svd2 2026-09-11T07:53:53,744 Created temporary directory: /tmp/pip-build-tracker-hhc4bwvb 2026-09-11T07:53:53,745 Initialized build tracking at /tmp/pip-build-tracker-hhc4bwvb 2026-09-11T07:53:53,745 Created build tracker: /tmp/pip-build-tracker-hhc4bwvb 2026-09-11T07:53:53,746 Entered build tracker: /tmp/pip-build-tracker-hhc4bwvb 2026-09-11T07:53:53,747 Created temporary directory: /tmp/pip-wheel-psxh9knm 2026-09-11T07:53:53,749 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 2026-09-11T07:53:53,752 Created temporary directory: /tmp/pip-ephem-wheel-cache-q0lsw8ca 2026-09-11T07:53:53,774 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2026-09-11T07:53:53,778 2 location(s) to search for versions of mlatom: 2026-09-11T07:53:53,778 * https://pypi.org/simple/mlatom/ 2026-09-11T07:53:53,778 * https://www.piwheels.org/simple/mlatom/ 2026-09-11T07:53:53,779 Fetching project page and analyzing links: https://pypi.org/simple/mlatom/ 2026-09-11T07:53:53,779 Getting page https://pypi.org/simple/mlatom/ 2026-09-11T07:53:53,781 Found index url https://pypi.org/simple 2026-09-11T07:53:54,019 Fetched page https://pypi.org/simple/mlatom/ as application/vnd.pypi.simple.v1+json 2026-09-11T07:53:54,044 Found link https://files.pythonhosted.org/packages/5b/e9/8d9312076e57d185dd6aca0554dcdf867181dec45166b7e952ccf7f663a1/MLatom-1.2.1.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.6), version: 1.2.1 2026-09-11T07:53:54,045 Found link https://files.pythonhosted.org/packages/3f/42/d6eded4f6ed29db7b48b371876692b80c05e2479f5437decef2ccf97037c/MLatom-1.2.2.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7), version: 1.2.2 2026-09-11T07:53:54,046 Found link https://files.pythonhosted.org/packages/bb/d5/dd92e9829debcb02f50abfbd806b5f7882dc72a82d675ac5cd9b570833c8/MLatom-1.2.3.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7), version: 1.2.3 2026-09-11T07:53:54,047 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/3c/1a/c607a0eef3db8ca171fff2ecc79d69825926d958d7078731556dfcf7d737/MLatom-2.0.0-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,048 Found link https://files.pythonhosted.org/packages/32/a5/4295b7c42d3826ecde0e38d64d1098bf3be284f7ce407d3e0eb0f083c6e8/MLatom-2.0.0.tar.gz (from https://pypi.org/simple/mlatom/) 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2026-09-11T07:53:54,054 Found link https://files.pythonhosted.org/packages/67/d8/75b095e781789f1e3bb9cb9fa0cdf211f09f5ef717b473cc8e79ad75095f/MLatom-2.0.3.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7), version: 2.0.3 2026-09-11T07:53:54,055 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/cf/46/13b88b729912395303db6b893624be4e5d2e957747cfb3523b6dde7c54f0/MLatom-2.0.4-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,056 Found link https://files.pythonhosted.org/packages/3e/93/7077d17483c42137375d0da6b431eeac7ea661ac3b450659f6fb5ba0376c/MLatom-2.0.4.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7), version: 2.0.4 2026-09-11T07:53:54,057 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/c2/ac/a1ed7f0cca44f0934549797da8f3dbc14ac9a5f79aa86a10b28d02afcf16/MLatom-2.0.5-py3-none-any.whl (from 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2026-09-11T07:53:54,066 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/3c/9a/520c41acf49cbf17b9a228928e99943d79ceb7f4e6777226fe9cb817bb99/MLatom-2.3-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,067 Found link https://files.pythonhosted.org/packages/62/1d/7ce303a2804c5db6e673009a540eedd42ff5409449113858dec6c174b9dc/MLatom-2.3.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7), version: 2.3 2026-09-11T07:53:54,068 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/07/1f/bea9aa16868588414033765a766d89a1872b072c3da6241c206d896ac098/MLatom-2.3.1-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,069 Found link https://files.pythonhosted.org/packages/69/e1/b6275c301a62fa6c4e9e46b08d801bca9a8b3bc53d34e757e7f38b177432/MLatom-2.3.1.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7), version: 2.3.1 2026-09-11T07:53:54,069 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/b9/43/23a61cab7df7f3afe54bf2488638d0fcea1bac7ff019578aa7e838ef305a/MLatom-2.3.2-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,070 Found link https://files.pythonhosted.org/packages/26/f9/1e1575ff5d9a03db1b5b9273970977e568a5910fb77c662ed40261831be2/MLatom-2.3.2.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.7), version: 2.3.2 2026-09-11T07:53:54,071 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/51/d5/50d532cab2c551ff9768a3481bcae7e9edb661be6a0d761e1ce4cc7dd8c1/MLatom-2.3.3-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.8) 2026-09-11T07:53:54,072 Found link https://files.pythonhosted.org/packages/c2/b0/9eb768787fd8f66b5f04c761d13ddc2fb622ba6bb6e667f57c65940ade40/MLatom-2.3.3.tar.gz (from 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version: 3.1.0 2026-09-11T07:53:54,078 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/b0/6f/527950a2ea8e17e49b529825b94b3ba45dc6e53409ae15b95222f4630063/mlatom-3.1.1-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.8) 2026-09-11T07:53:54,079 Found link https://files.pythonhosted.org/packages/37/74/261f728e64dcd9d76f5b8c4b4beeed75051e1fc3e2e8fb04bcd0f8d67fd3/mlatom-3.1.1.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.8), version: 3.1.1 2026-09-11T07:53:54,079 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/f3/eb/14e54a5508a27a5b0e0c9ba131216cae7a0cb65a8283fcbbd042aec5e15d/mlatom-3.2.0-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.8) 2026-09-11T07:53:54,080 Found link https://files.pythonhosted.org/packages/f8/c4/3686617422faed58e93c9156c3cf133817dabdc75ee570020955da7e0b7a/mlatom-3.2.0.tar.gz (from 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2026-09-11T07:53:54,086 Found link https://files.pythonhosted.org/packages/a5/b3/380f09149ff02ebbe7110fb61f89bb55fecb2b4a9c15c88f3c8b7aab19d6/mlatom-3.6.0.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.8), version: 3.6.0 2026-09-11T07:53:54,087 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/9b/6b/0805f8acffd174677f9706ad5f5649f5d4f8525051b74e2deb4121e56bcc/mlatom-3.7.0-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.8) 2026-09-11T07:53:54,088 Found link https://files.pythonhosted.org/packages/0d/1b/f5ee3dfe159302b184a672578e8391bd3f992aacbd941d96f5a09802ad45/mlatom-3.7.0.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.8), version: 3.7.0 2026-09-11T07:53:54,088 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/74/63/62a3eb0913eb161c9f2ac6041fae7492099e5ef22667e2602f6b5fe2cb7d/mlatom-3.7.1-py3-none-any.whl (from 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2026-09-11T07:53:54,143 Found link https://files.pythonhosted.org/packages/16/15/271a37e49e2cbf3f54c6ae6ae3bc481a4b21dd147e7d942cee51047f6903/mlatom-3.25.0.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.9), version: 3.25.0 2026-09-11T07:53:54,144 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/5d/6d/0a2b0c05e3f61d3a242c7806a6bfa98aa415cf12314685d61d7c1f2cb747/mlatom-3.25.1-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.9) 2026-09-11T07:53:54,145 Found link https://files.pythonhosted.org/packages/43/53/067ca4b466020fe69653820c1144172a9b6b9d09411c94bf444cc5746d22/mlatom-3.25.1.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.9), version: 3.25.1 2026-09-11T07:53:54,146 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/7c/60/c9c8f56212ae65da9debeed6b15b2c701246c8e095cf58b758f8c8b84861/mlatom-3.25.2-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.9) 2026-09-11T07:53:54,146 Found link https://files.pythonhosted.org/packages/0f/05/a12e93f8e990cb77fcb6c14e264a04476e169ca0edfbf0400b807a184cf9/mlatom-3.25.2.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.9), version: 3.25.2 2026-09-11T07:53:54,147 Skipping link: No binaries permitted for mlatom: https://files.pythonhosted.org/packages/73/f2/8906115faf59cfccc2d48d320154d672e155f849a0b3bfe03f2d64233fa9/mlatom-3.25.3-py3-none-any.whl (from https://pypi.org/simple/mlatom/) (requires-python:>=3.9) 2026-09-11T07:53:54,148 Found link https://files.pythonhosted.org/packages/4e/97/4c83cb4ef891ff4c9fea747985b4eed7bd984df9829e784c7d83727008b0/mlatom-3.25.3.tar.gz (from https://pypi.org/simple/mlatom/) (requires-python:>=3.9), version: 3.25.3 2026-09-11T07:53:54,149 Skipping link: No binaries permitted for mlatom: 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https://archive1.piwheels.org/simple/mlatom/MLatom-2.2-py3-none-any.whl#sha256=8cba979c185324178a992473ffe284ccedb28a51fd6f3ffb9dd92cb1b68e1b3f (from https://www.piwheels.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,397 Skipping link: No binaries permitted for mlatom: https://archive1.piwheels.org/simple/mlatom/MLatom-2.1.3-py3-none-any.whl#sha256=db12a2a3c07461ffc1fb5e75ea2e8cf01f3b46cab89fb1d15e459095c31c282e (from https://www.piwheels.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,398 Skipping link: No binaries permitted for mlatom: https://archive1.piwheels.org/simple/mlatom/MLatom-2.1.2-py3-none-any.whl#sha256=0fdf13b336546beeea75c0e0f58589c1a7332be1ff691a94eae699edc5cfade7 (from https://www.piwheels.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,398 Skipping link: No binaries permitted for mlatom: 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https://archive1.piwheels.org/simple/mlatom/MLatom-2.0.3-py3-none-any.whl#sha256=e30f21182de2cba5f6f2006d80601751ccc974e7bd1074b8fd93edc8938259d9 (from https://www.piwheels.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,401 Skipping link: No binaries permitted for mlatom: https://archive1.piwheels.org/simple/mlatom/MLatom-2.0.2-py3-none-any.whl#sha256=f670bbf50157338f65347b637f759f980f2b1a02c7e70ffcc5e90506b3e013b4 (from https://www.piwheels.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,401 Skipping link: No binaries permitted for mlatom: https://archive1.piwheels.org/simple/mlatom/MLatom-2.0.1-py3-none-any.whl#sha256=44c55472a4a43926fcf2093b24d9ac62d431bf6e9e2b61183e362661d834091d (from https://www.piwheels.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,402 Skipping link: No binaries permitted for mlatom: https://archive1.piwheels.org/simple/mlatom/MLatom-2.0.0-py3-none-any.whl#sha256=4976033808e8a1dd7eb391e2a42e99a34645d5f97787815b8347ea695a272a65 (from https://www.piwheels.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,402 Skipping link: No binaries permitted for mlatom: https://archive1.piwheels.org/simple/mlatom/MLatom-1.2.3-py3-none-any.whl#sha256=eaa7de3a8735c8da9eaf2ba08d186947281b7a117954c84a447b7c7b5882d774 (from https://www.piwheels.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,403 Skipping link: No binaries permitted for mlatom: https://archive1.piwheels.org/simple/mlatom/MLatom-1.2.2-py3-none-any.whl#sha256=6d354d368a5139ad83458612f96b7f7d6e496bb6264fdd93845b8c8f992c6ea0 (from https://www.piwheels.org/simple/mlatom/) (requires-python:>=3.7) 2026-09-11T07:53:54,403 Skipping link: No binaries permitted for mlatom: https://archive1.piwheels.org/simple/mlatom/MLatom-1.2.1-py3-none-any.whl#sha256=180c9acf5fd60b2cd4bce36140bdd8ca8b11022d147b1ef56efaea2479418480 (from https://www.piwheels.org/simple/mlatom/) (requires-python:>=3.6) 2026-09-11T07:53:54,404 Skipping link: not a file: https://www.piwheels.org/simple/mlatom/ 2026-09-11T07:53:54,404 Skipping link: not a file: https://pypi.org/simple/mlatom/ 2026-09-11T07:53:54,431 Given no hashes to check 1 links for project 'mlatom': discarding no candidates 2026-09-11T07:53:54,450 Collecting mlatom==3.25.4 2026-09-11T07:53:54,452 Created temporary directory: /tmp/pip-unpack-9yw8hyl4 2026-09-11T07:53:54,617 Downloading mlatom-3.25.4.tar.gz (61.9 MB) 2026-09-11T07:54:03,517 Added mlatom==3.25.4 from https://files.pythonhosted.org/packages/28/d4/82821484d090417d2f577ebf1a99474d5ae1757a5ee403e6b884fc325760/mlatom-3.25.4.tar.gz to build tracker '/tmp/pip-build-tracker-hhc4bwvb' 2026-09-11T07:54:03,519 Running setup.py (path:/tmp/pip-wheel-psxh9knm/mlatom_f3699d501c3a4b8b82c12845bd531039/setup.py) egg_info for package mlatom 2026-09-11T07:54:03,520 Created temporary directory: /tmp/pip-pip-egg-info-4thhpbqi 2026-09-11T07:54:03,521 Preparing metadata (setup.py): started 2026-09-11T07:54:03,522 Running command python setup.py egg_info 2026-09-11T07:54:04,457 /usr/local/lib/python3.11/dist-packages/setuptools/dist.py:765: SetuptoolsDeprecationWarning: License classifiers are deprecated. 2026-09-11T07:54:04,457 !! 2026-09-11T07:54:04,458 ******************************************************************************** 2026-09-11T07:54:04,459 Please consider removing the following classifiers in favor of a SPDX license expression: 2026-09-11T07:54:04,460 License :: OSI Approved :: Apache Software License 2026-09-11T07:54:04,461 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-09-11T07:54:04,462 ******************************************************************************** 2026-09-11T07:54:04,463 !! 2026-09-11T07:54:04,463 self._finalize_license_expression() 2026-09-11T07:54:04,488 running egg_info 2026-09-11T07:54:04,516 creating /tmp/pip-pip-egg-info-4thhpbqi/mlatom.egg-info 2026-09-11T07:54:04,517 writing /tmp/pip-pip-egg-info-4thhpbqi/mlatom.egg-info/PKG-INFO 2026-09-11T07:54:04,521 writing dependency_links to /tmp/pip-pip-egg-info-4thhpbqi/mlatom.egg-info/dependency_links.txt 2026-09-11T07:54:04,523 writing entry points to /tmp/pip-pip-egg-info-4thhpbqi/mlatom.egg-info/entry_points.txt 2026-09-11T07:54:04,525 writing requirements to /tmp/pip-pip-egg-info-4thhpbqi/mlatom.egg-info/requires.txt 2026-09-11T07:54:04,526 writing top-level names to /tmp/pip-pip-egg-info-4thhpbqi/mlatom.egg-info/top_level.txt 2026-09-11T07:54:04,528 writing manifest file '/tmp/pip-pip-egg-info-4thhpbqi/mlatom.egg-info/SOURCES.txt' 2026-09-11T07:54:04,684 reading manifest file '/tmp/pip-pip-egg-info-4thhpbqi/mlatom.egg-info/SOURCES.txt' 2026-09-11T07:54:04,685 adding license file 'LICENSE.txt' 2026-09-11T07:54:04,692 writing manifest file '/tmp/pip-pip-egg-info-4thhpbqi/mlatom.egg-info/SOURCES.txt' 2026-09-11T07:54:04,804 Preparing metadata (setup.py): finished with status 'done' 2026-09-11T07:54:04,809 Source in /tmp/pip-wheel-psxh9knm/mlatom_f3699d501c3a4b8b82c12845bd531039 has version 3.25.4, which satisfies requirement mlatom==3.25.4 from https://files.pythonhosted.org/packages/28/d4/82821484d090417d2f577ebf1a99474d5ae1757a5ee403e6b884fc325760/mlatom-3.25.4.tar.gz 2026-09-11T07:54:04,810 Removed mlatom==3.25.4 from https://files.pythonhosted.org/packages/28/d4/82821484d090417d2f577ebf1a99474d5ae1757a5ee403e6b884fc325760/mlatom-3.25.4.tar.gz from build tracker '/tmp/pip-build-tracker-hhc4bwvb' 2026-09-11T07:54:04,817 Created temporary directory: /tmp/pip-unpack-c7l7h6a4 2026-09-11T07:54:04,817 Building wheels for collected packages: mlatom 2026-09-11T07:54:04,822 Created temporary directory: /tmp/pip-wheel-kk1b7dmb 2026-09-11T07:54:04,823 Building wheel for mlatom (setup.py): started 2026-09-11T07:54:04,824 Destination directory: /tmp/pip-wheel-kk1b7dmb 2026-09-11T07:54:04,824 Running command python setup.py bdist_wheel 2026-09-11T07:54:05,687 /usr/local/lib/python3.11/dist-packages/setuptools/dist.py:765: SetuptoolsDeprecationWarning: License classifiers are deprecated. 2026-09-11T07:54:05,687 !! 2026-09-11T07:54:05,688 ******************************************************************************** 2026-09-11T07:54:05,688 Please consider removing the following classifiers in favor of a SPDX license expression: 2026-09-11T07:54:05,690 License :: OSI Approved :: Apache Software License 2026-09-11T07:54:05,691 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-09-11T07:54:05,691 ******************************************************************************** 2026-09-11T07:54:05,692 !! 2026-09-11T07:54:05,693 self._finalize_license_expression() 2026-09-11T07:54:05,693 running bdist_wheel 2026-09-11T07:54:05,821 running build 2026-09-11T07:54:05,822 running build_py 2026-09-11T07:54:05,825 creating build/lib/mlatom 2026-09-11T07:54:05,827 copying src/mlatom/initial_conditions.py -> build/lib/mlatom 2026-09-11T07:54:05,830 copying src/mlatom/al.py -> build/lib/mlatom 2026-09-11T07:54:05,833 copying src/mlatom/universal_mlips.py -> build/lib/mlatom 2026-09-11T07:54:05,836 copying src/mlatom/functionsGICnet.py -> build/lib/mlatom 2026-09-11T07:54:05,839 copying src/mlatom/MLatom.py -> build/lib/mlatom 2026-09-11T07:54:05,841 copying src/mlatom/krr_julia.py -> build/lib/mlatom 2026-09-11T07:54:05,843 copying src/mlatom/interface_MLatomF.py -> build/lib/mlatom 2026-09-11T07:54:05,846 copying src/mlatom/shell_cmd.py -> build/lib/mlatom 2026-09-11T07:54:05,848 copying src/mlatom/mlatom_gui.py -> build/lib/mlatom 2026-09-11T07:54:05,851 copying src/mlatom/ciopt.py -> build/lib/mlatom 2026-09-11T07:54:05,854 copying src/mlatom/omnip1_nn.py -> build/lib/mlatom 2026-09-11T07:54:05,856 copying src/mlatom/spectra.py -> build/lib/mlatom 2026-09-11T07:54:05,859 copying src/mlatom/aiqm1.py -> build/lib/mlatom 2026-09-11T07:54:05,862 copying src/mlatom/gap_md.py -> build/lib/mlatom 2026-09-11T07:54:05,890 copying src/mlatom/EEEDDDD_nn.py -> build/lib/mlatom 2026-09-11T07:54:05,892 copying src/mlatom/xyz.py -> build/lib/mlatom 2026-09-11T07:54:05,894 copying src/mlatom/stats.py -> build/lib/mlatom 2026-09-11T07:54:05,897 copying src/mlatom/utils.py -> build/lib/mlatom 2026-09-11T07:54:05,899 copying src/mlatom/md2vibr_cmd.py -> build/lib/mlatom 2026-09-11T07:54:05,902 copying src/mlatom/stopper.py -> build/lib/mlatom 2026-09-11T07:54:05,903 copying src/mlatom/sliceData.py -> build/lib/mlatom 2026-09-11T07:54:05,906 copying src/mlatom/EEEDDDD.py -> build/lib/mlatom 2026-09-11T07:54:05,910 copying src/mlatom/simulations.py -> build/lib/mlatom 2026-09-11T07:54:05,913 copying src/mlatom/al_utils.py -> build/lib/mlatom 2026-09-11T07:54:05,918 copying src/mlatom/md_parallel.py -> build/lib/mlatom 2026-09-11T07:54:05,920 copying src/mlatom/ccsdtstarcbs.py -> build/lib/mlatom 2026-09-11T07:54:05,922 copying src/mlatom/md_cmd.py -> build/lib/mlatom 2026-09-11T07:54:05,924 copying src/mlatom/decorators.py -> build/lib/mlatom 2026-09-11T07:54:05,926 copying src/mlatom/composite_methods.py -> build/lib/mlatom 2026-09-11T07:54:05,928 copying src/mlatom/dens.py -> build/lib/mlatom 2026-09-11T07:54:05,931 copying src/mlatom/args_class.py -> build/lib/mlatom 2026-09-11T07:54:05,933 copying src/mlatom/model_cls.py -> build/lib/mlatom 2026-09-11T07:54:05,937 copying src/mlatom/models.py -> build/lib/mlatom 2026-09-11T07:54:05,940 copying src/mlatom/__init__.py -> build/lib/mlatom 2026-09-11T07:54:05,942 copying src/mlatom/GICnet.py -> build/lib/mlatom 2026-09-11T07:54:05,945 copying src/mlatom/md.py -> build/lib/mlatom 2026-09-11T07:54:05,947 copying src/mlatom/ML_NEA.py -> build/lib/mlatom 2026-09-11T07:54:05,952 copying src/mlatom/MLTPA.py -> build/lib/mlatom 2026-09-11T07:54:05,955 copying src/mlatom/irc.py -> build/lib/mlatom 2026-09-11T07:54:05,957 copying src/mlatom/aiqm2.py -> build/lib/mlatom 2026-09-11T07:54:05,960 copying src/mlatom/kreg_api.py -> build/lib/mlatom 2026-09-11T07:54:05,963 copying src/mlatom/EEEDDDD_descriptor.py -> build/lib/mlatom 2026-09-11T07:54:05,965 copying src/mlatom/thermostat.py -> build/lib/mlatom 2026-09-11T07:54:05,967 copying src/mlatom/log.py -> build/lib/mlatom 2026-09-11T07:54:05,969 copying src/mlatom/doc.py -> build/lib/mlatom 2026-09-11T07:54:05,972 copying src/mlatom/plot.py -> build/lib/mlatom 2026-09-11T07:54:05,974 copying src/mlatom/conversions.py -> build/lib/mlatom 2026-09-11T07:54:05,976 copying src/mlatom/gen_ts_methods.py -> build/lib/mlatom 2026-09-11T07:54:05,978 copying src/mlatom/namd.py -> build/lib/mlatom 2026-09-11T07:54:05,982 copying src/mlatom/omnip1.py -> build/lib/mlatom 2026-09-11T07:54:05,984 copying src/mlatom/_update_check.py -> build/lib/mlatom 2026-09-11T07:54:05,986 copying src/mlatom/data.py -> build/lib/mlatom 2026-09-11T07:54:05,992 copying src/mlatom/_version.py -> build/lib/mlatom 2026-09-11T07:54:05,994 copying src/mlatom/constants.py -> build/lib/mlatom 2026-09-11T07:54:05,997 copying src/mlatom/MLtasks.py -> build/lib/mlatom 2026-09-11T07:54:06,000 copying src/mlatom/header.py -> build/lib/mlatom 2026-09-11T07:54:06,002 copying src/mlatom/_version_static.py -> build/lib/mlatom 2026-09-11T07:54:06,004 copying src/mlatom/md2vibr.py -> build/lib/mlatom 2026-09-11T07:54:06,007 copying src/mlatom/dispersion.py -> build/lib/mlatom 2026-09-11T07:54:06,009 copying src/mlatom/delta_learning.py -> build/lib/mlatom 2026-09-11T07:54:06,012 creating build/lib/mlatom/julia 2026-09-11T07:54:06,014 copying src/mlatom/julia/kreg_julia.py -> build/lib/mlatom/julia 2026-09-11T07:54:06,016 copying src/mlatom/julia/__init__.py -> build/lib/mlatom/julia 2026-09-11T07:54:06,018 creating build/lib/mlatom/mlatom_models 2026-09-11T07:54:06,019 copying src/mlatom/mlatom_models/__init__.py -> build/lib/mlatom/mlatom_models 2026-09-11T07:54:06,021 creating build/lib/mlatom/addons 2026-09-11T07:54:06,022 copying src/mlatom/addons/__init__.py -> build/lib/mlatom/addons 2026-09-11T07:54:06,025 creating build/lib/mlatom/mltpa 2026-09-11T07:54:06,026 copying src/mlatom/mltpa/__init__.py -> build/lib/mlatom/mltpa 2026-09-11T07:54:06,028 creating build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,029 copying src/mlatom/MLatomF_src/__init__.py -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,032 creating build/lib/mlatom/interfaces 2026-09-11T07:54:06,033 copying src/mlatom/interfaces/xtb_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,036 copying src/mlatom/interfaces/pyscf_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,038 copying src/mlatom/interfaces/turbomole_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,041 copying src/mlatom/interfaces/gaussian_external.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,043 copying src/mlatom/interfaces/aimnet2_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,045 copying src/mlatom/interfaces/orca_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,048 copying src/mlatom/interfaces/gap_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,051 copying src/mlatom/interfaces/dftd4_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,053 copying src/mlatom/interfaces/sgdml_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,056 copying src/mlatom/interfaces/physnet_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,059 copying src/mlatom/interfaces/__init__.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,060 copying src/mlatom/interfaces/mace_methods_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,063 copying src/mlatom/interfaces/geometric_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,065 copying src/mlatom/interfaces/mace_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,068 copying src/mlatom/interfaces/torchani_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,073 copying src/mlatom/interfaces/dftbplus_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,076 copying src/mlatom/interfaces/ase_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,078 copying src/mlatom/interfaces/gaussian_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,081 copying src/mlatom/interfaces/pysisyphus_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,084 copying src/mlatom/interfaces/columbus_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,087 copying src/mlatom/interfaces/dpmd_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,089 copying src/mlatom/interfaces/dftd3_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,092 copying src/mlatom/interfaces/mndo_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,094 copying src/mlatom/interfaces/sparrow_interface.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,097 copying src/mlatom/interfaces/torchani_heavy_parts.py -> build/lib/mlatom/interfaces 2026-09-11T07:54:06,100 creating build/lib/mlatom/fortran 2026-09-11T07:54:06,101 copying src/mlatom/fortran/__init__.py -> build/lib/mlatom/fortran 2026-09-11T07:54:06,103 copying src/mlatom/fortran/compile.py -> build/lib/mlatom/fortran 2026-09-11T07:54:06,105 creating build/lib/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:06,107 copying src/mlatom/mlatom_models/aiqm1_model/__init__.py -> build/lib/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:06,109 creating build/lib/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:06,111 copying src/mlatom/mlatom_models/aiqm2_model/__init__.py -> build/lib/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:06,114 creating build/lib/mlatom/addons/uaiqm 2026-09-11T07:54:06,115 copying src/mlatom/addons/uaiqm/uaiqm.py -> build/lib/mlatom/addons/uaiqm 2026-09-11T07:54:06,118 copying src/mlatom/addons/uaiqm/__init__.py -> build/lib/mlatom/addons/uaiqm 2026-09-11T07:54:06,120 creating build/lib/mlatom/addons/aiqm3 2026-09-11T07:54:06,121 copying src/mlatom/addons/aiqm3/aiqm3.py -> build/lib/mlatom/addons/aiqm3 2026-09-11T07:54:06,124 copying src/mlatom/addons/aiqm3/__init__.py -> build/lib/mlatom/addons/aiqm3 2026-09-11T07:54:06,126 creating build/lib/mlatom/addons/omnip2x 2026-09-11T07:54:06,127 copying src/mlatom/addons/omnip2x/omnip2x.py -> build/lib/mlatom/addons/omnip2x 2026-09-11T07:54:06,130 copying src/mlatom/addons/omnip2x/vecmsani.py -> build/lib/mlatom/addons/omnip2x 2026-09-11T07:54:06,134 copying src/mlatom/addons/omnip2x/__init__.py -> build/lib/mlatom/addons/omnip2x 2026-09-11T07:54:06,136 copying src/mlatom/addons/omnip2x/re_state_input_net.py -> build/lib/mlatom/addons/omnip2x 2026-09-11T07:54:06,138 creating build/lib/mlatom/fortran/np2 2026-09-11T07:54:06,139 copying src/mlatom/fortran/np2/__init__.py -> build/lib/mlatom/fortran/np2 2026-09-11T07:54:06,142 creating build/lib/mlatom/fortran/np1 2026-09-11T07:54:06,143 copying src/mlatom/fortran/np1/__init__.py -> build/lib/mlatom/fortran/np1 2026-09-11T07:54:06,211 copying src/mlatom/MLatomF -> build/lib/mlatom 2026-09-11T07:54:06,488 copying src/mlatom/ref.json -> build/lib/mlatom 2026-09-11T07:54:06,491 copying src/mlatom/cs.so -> build/lib/mlatom 2026-09-11T07:54:06,494 copying src/mlatom/julia/kernel_function.jl -> build/lib/mlatom/julia 2026-09-11T07:54:06,496 copying src/mlatom/julia/mathUtils.jl -> build/lib/mlatom/julia 2026-09-11T07:54:06,498 copying src/mlatom/julia/krr.jl -> build/lib/mlatom/julia 2026-09-11T07:54:06,501 copying src/mlatom/julia/stopper.jl -> build/lib/mlatom/julia 2026-09-11T07:54:06,503 copying src/mlatom/julia/KREG.jl -> build/lib/mlatom/julia 2026-09-11T07:54:06,506 copying src/mlatom/mltpa/mff.txt -> build/lib/mlatom/mltpa 2026-09-11T07:54:06,508 copying src/mlatom/mltpa/mltpa2022_2_new_.pkl -> build/lib/mlatom/mltpa 2026-09-11T07:54:06,547 copying src/mlatom/mltpa/mltpa2022_2.pkl -> build/lib/mlatom/mltpa 2026-09-11T07:54:06,630 copying src/mlatom/MLatomF_src/cs.cpp -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,633 copying src/mlatom/MLatomF_src/MLatomFInfo.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,635 copying src/mlatom/MLatomF_src/dataset.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,639 copying src/mlatom/MLatomF_src/statistics.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,642 copying src/mlatom/MLatomF_src/mathUtils.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,646 copying src/mlatom/MLatomF_src/D_ID.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,649 copying src/mlatom/MLatomF_src/strings.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,651 copying src/mlatom/MLatomF_src/A_KRR.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,655 copying src/mlatom/MLatomF_src/types.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,658 copying src/mlatom/MLatomF_src/D_CoulombMatrix.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,661 copying src/mlatom/MLatomF_src/stopper.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,664 copying src/mlatom/MLatomF_src/molDescr.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,667 copying src/mlatom/MLatomF_src/precision.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,669 copying src/mlatom/MLatomF_src/analyze.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,672 copying src/mlatom/MLatomF_src/constants.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,675 copying src/mlatom/MLatomF_src/A_KRR_kernel.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,680 copying src/mlatom/MLatomF_src/MLmodel.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,684 copying src/mlatom/MLatomF_src/MLatomF.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,687 copying src/mlatom/MLatomF_src/D_rel2eq.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,690 copying src/mlatom/MLatomF_src/sampling.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,694 copying src/mlatom/MLatomF_src/optionsModule.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,698 copying src/mlatom/MLatomF_src/timing.f90 -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,701 copying src/mlatom/MLatomF_src/Makefile -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,704 copying src/mlatom/MLatomF_src/Makefile.intel -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,706 copying src/mlatom/MLatomF_src/recover.sh -> build/lib/mlatom/MLatomF_src 2026-09-11T07:54:06,709 copying src/mlatom/interfaces/xtb -> build/lib/mlatom/interfaces 2026-09-11T07:54:07,529 copying src/mlatom/fortran/mathUtils.f90 -> build/lib/mlatom/fortran 2026-09-11T07:54:07,531 copying src/mlatom/fortran/stopper.f90 -> build/lib/mlatom/fortran 2026-09-11T07:54:07,534 copying src/mlatom/fortran/KREG.f90 -> build/lib/mlatom/fortran 2026-09-11T07:54:07,537 copying src/mlatom/mlatom_models/aiqm1_model/cv2.pt -> build/lib/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:07,570 copying src/mlatom/mlatom_models/aiqm1_model/cv4.pt -> build/lib/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:07,599 copying src/mlatom/mlatom_models/aiqm1_model/cv7.pt -> build/lib/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:07,632 copying src/mlatom/mlatom_models/aiqm1_model/cv5.pt -> build/lib/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:07,660 copying src/mlatom/mlatom_models/aiqm1_model/cv6.pt -> build/lib/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:07,698 copying src/mlatom/mlatom_models/aiqm1_model/cv3.pt -> build/lib/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:07,732 copying src/mlatom/mlatom_models/aiqm1_model/cv0.pt -> build/lib/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:07,760 copying src/mlatom/mlatom_models/aiqm1_model/cv1.pt -> build/lib/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:07,790 copying src/mlatom/mlatom_models/aiqm2_model/cv2.pt -> build/lib/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:07,830 copying src/mlatom/mlatom_models/aiqm2_model/cv4.pt -> build/lib/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:07,874 copying src/mlatom/mlatom_models/aiqm2_model/cv7.pt -> build/lib/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:07,916 copying src/mlatom/mlatom_models/aiqm2_model/cv5.pt -> build/lib/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:07,963 copying src/mlatom/mlatom_models/aiqm2_model/cv6.pt -> build/lib/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,003 copying src/mlatom/mlatom_models/aiqm2_model/cv3.pt -> build/lib/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,047 copying src/mlatom/mlatom_models/aiqm2_model/cv0.pt -> build/lib/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,091 copying src/mlatom/mlatom_models/aiqm2_model/cv1.pt -> build/lib/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,135 copying src/mlatom/fortran/np2/KREG.so -> build/lib/mlatom/fortran/np2 2026-09-11T07:54:08,158 copying src/mlatom/fortran/np1/KREG.so -> build/lib/mlatom/fortran/np1 2026-09-11T07:54:08,226 /usr/local/lib/python3.11/dist-packages/setuptools/_distutils/cmd.py:90: SetuptoolsDeprecationWarning: setup.py install is deprecated. 2026-09-11T07:54:08,226 !! 2026-09-11T07:54:08,228 ******************************************************************************** 2026-09-11T07:54:08,228 Please avoid running ``setup.py`` directly. 2026-09-11T07:54:08,229 Instead, use pypa/build, pypa/installer or other 2026-09-11T07:54:08,229 standards-based tools. 2026-09-11T07:54:08,231 This deprecation is overdue, please update your project and remove deprecated 2026-09-11T07:54:08,231 calls to avoid build errors in the future. 2026-09-11T07:54:08,233 See https://blog.ganssle.io/articles/2021/10/setup-py-deprecated.html for details. 2026-09-11T07:54:08,233 ******************************************************************************** 2026-09-11T07:54:08,234 !! 2026-09-11T07:54:08,235 self.initialize_options() 2026-09-11T07:54:08,256 installing to build/bdist.linux-armv7l/wheel 2026-09-11T07:54:08,256 running install 2026-09-11T07:54:08,279 running install_lib 2026-09-11T07:54:08,307 creating build/bdist.linux-armv7l/wheel 2026-09-11T07:54:08,310 creating build/bdist.linux-armv7l/wheel/mlatom 2026-09-11T07:54:08,312 copying build/lib/mlatom/initial_conditions.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,315 copying build/lib/mlatom/ref.json -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,317 copying build/lib/mlatom/al.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,321 copying build/lib/mlatom/universal_mlips.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,323 copying build/lib/mlatom/functionsGICnet.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,326 copying build/lib/mlatom/MLatom.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,329 copying build/lib/mlatom/krr_julia.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,331 copying build/lib/mlatom/interface_MLatomF.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,333 copying build/lib/mlatom/shell_cmd.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,335 copying build/lib/mlatom/mlatom_gui.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,339 copying build/lib/mlatom/ciopt.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,342 copying build/lib/mlatom/omnip1_nn.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,345 copying build/lib/mlatom/spectra.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,348 copying build/lib/mlatom/cs.so -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,351 copying build/lib/mlatom/aiqm1.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,355 copying build/lib/mlatom/gap_md.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,357 copying build/lib/mlatom/EEEDDDD_nn.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,360 copying build/lib/mlatom/xyz.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,362 copying build/lib/mlatom/stats.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,365 copying build/lib/mlatom/utils.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,367 copying build/lib/mlatom/md2vibr_cmd.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,370 copying build/lib/mlatom/stopper.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,373 creating build/bdist.linux-armv7l/wheel/mlatom/julia 2026-09-11T07:54:08,374 copying build/lib/mlatom/julia/kreg_julia.py -> build/bdist.linux-armv7l/wheel/./mlatom/julia 2026-09-11T07:54:08,377 copying build/lib/mlatom/julia/kernel_function.jl -> build/bdist.linux-armv7l/wheel/./mlatom/julia 2026-09-11T07:54:08,380 copying build/lib/mlatom/julia/mathUtils.jl -> build/bdist.linux-armv7l/wheel/./mlatom/julia 2026-09-11T07:54:08,382 copying build/lib/mlatom/julia/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/julia 2026-09-11T07:54:08,384 copying build/lib/mlatom/julia/krr.jl -> build/bdist.linux-armv7l/wheel/./mlatom/julia 2026-09-11T07:54:08,386 copying build/lib/mlatom/julia/stopper.jl -> build/bdist.linux-armv7l/wheel/./mlatom/julia 2026-09-11T07:54:08,388 copying build/lib/mlatom/julia/KREG.jl -> build/bdist.linux-armv7l/wheel/./mlatom/julia 2026-09-11T07:54:08,391 copying build/lib/mlatom/sliceData.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,394 copying build/lib/mlatom/EEEDDDD.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,397 copying build/lib/mlatom/simulations.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:08,401 creating build/bdist.linux-armv7l/wheel/mlatom/mlatom_models 2026-09-11T07:54:08,404 creating build/bdist.linux-armv7l/wheel/mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:08,405 copying build/lib/mlatom/mlatom_models/aiqm1_model/cv2.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:08,444 copying build/lib/mlatom/mlatom_models/aiqm1_model/cv4.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:08,475 copying build/lib/mlatom/mlatom_models/aiqm1_model/cv7.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:08,504 copying build/lib/mlatom/mlatom_models/aiqm1_model/cv5.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:08,533 copying build/lib/mlatom/mlatom_models/aiqm1_model/cv6.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:08,562 copying build/lib/mlatom/mlatom_models/aiqm1_model/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:08,564 copying build/lib/mlatom/mlatom_models/aiqm1_model/cv3.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:08,591 copying build/lib/mlatom/mlatom_models/aiqm1_model/cv0.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:08,621 copying build/lib/mlatom/mlatom_models/aiqm1_model/cv1.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm1_model 2026-09-11T07:54:08,655 copying build/lib/mlatom/mlatom_models/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models 2026-09-11T07:54:08,657 creating build/bdist.linux-armv7l/wheel/mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,659 copying build/lib/mlatom/mlatom_models/aiqm2_model/cv2.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,702 copying build/lib/mlatom/mlatom_models/aiqm2_model/cv4.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,743 copying build/lib/mlatom/mlatom_models/aiqm2_model/cv7.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,785 copying build/lib/mlatom/mlatom_models/aiqm2_model/cv5.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,826 copying build/lib/mlatom/mlatom_models/aiqm2_model/cv6.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,867 copying build/lib/mlatom/mlatom_models/aiqm2_model/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,869 copying build/lib/mlatom/mlatom_models/aiqm2_model/cv3.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,914 copying build/lib/mlatom/mlatom_models/aiqm2_model/cv0.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,955 copying build/lib/mlatom/mlatom_models/aiqm2_model/cv1.pt -> build/bdist.linux-armv7l/wheel/./mlatom/mlatom_models/aiqm2_model 2026-09-11T07:54:08,998 creating build/bdist.linux-armv7l/wheel/mlatom/addons 2026-09-11T07:54:09,000 creating build/bdist.linux-armv7l/wheel/mlatom/addons/uaiqm 2026-09-11T07:54:09,001 copying build/lib/mlatom/addons/uaiqm/uaiqm.py -> build/bdist.linux-armv7l/wheel/./mlatom/addons/uaiqm 2026-09-11T07:54:09,004 copying build/lib/mlatom/addons/uaiqm/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/addons/uaiqm 2026-09-11T07:54:09,007 creating build/bdist.linux-armv7l/wheel/mlatom/addons/aiqm3 2026-09-11T07:54:09,008 copying build/lib/mlatom/addons/aiqm3/aiqm3.py -> build/bdist.linux-armv7l/wheel/./mlatom/addons/aiqm3 2026-09-11T07:54:09,011 copying build/lib/mlatom/addons/aiqm3/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/addons/aiqm3 2026-09-11T07:54:09,013 copying build/lib/mlatom/addons/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/addons 2026-09-11T07:54:09,016 creating build/bdist.linux-armv7l/wheel/mlatom/addons/omnip2x 2026-09-11T07:54:09,017 copying build/lib/mlatom/addons/omnip2x/omnip2x.py -> build/bdist.linux-armv7l/wheel/./mlatom/addons/omnip2x 2026-09-11T07:54:09,020 copying build/lib/mlatom/addons/omnip2x/vecmsani.py -> build/bdist.linux-armv7l/wheel/./mlatom/addons/omnip2x 2026-09-11T07:54:09,025 copying build/lib/mlatom/addons/omnip2x/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/addons/omnip2x 2026-09-11T07:54:09,027 copying build/lib/mlatom/addons/omnip2x/re_state_input_net.py -> build/bdist.linux-armv7l/wheel/./mlatom/addons/omnip2x 2026-09-11T07:54:09,029 copying build/lib/mlatom/al_utils.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,035 creating build/bdist.linux-armv7l/wheel/mlatom/mltpa 2026-09-11T07:54:09,037 copying build/lib/mlatom/mltpa/mltpa2022_2_new_.pkl -> build/bdist.linux-armv7l/wheel/./mlatom/mltpa 2026-09-11T07:54:09,078 copying build/lib/mlatom/mltpa/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/mltpa 2026-09-11T07:54:09,080 copying build/lib/mlatom/mltpa/mff.txt -> build/bdist.linux-armv7l/wheel/./mlatom/mltpa 2026-09-11T07:54:09,083 copying build/lib/mlatom/mltpa/mltpa2022_2.pkl -> build/bdist.linux-armv7l/wheel/./mlatom/mltpa 2026-09-11T07:54:09,138 copying build/lib/mlatom/md_parallel.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,141 copying build/lib/mlatom/ccsdtstarcbs.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,145 creating build/bdist.linux-armv7l/wheel/mlatom/MLatomF_src 2026-09-11T07:54:09,147 copying build/lib/mlatom/MLatomF_src/MLatomFInfo.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,149 copying build/lib/mlatom/MLatomF_src/dataset.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,153 copying build/lib/mlatom/MLatomF_src/statistics.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,156 copying build/lib/mlatom/MLatomF_src/mathUtils.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,159 copying build/lib/mlatom/MLatomF_src/D_ID.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,161 copying build/lib/mlatom/MLatomF_src/strings.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,163 copying build/lib/mlatom/MLatomF_src/A_KRR.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,167 copying build/lib/mlatom/MLatomF_src/types.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,169 copying build/lib/mlatom/MLatomF_src/D_CoulombMatrix.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,171 copying build/lib/mlatom/MLatomF_src/recover.sh -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,173 copying build/lib/mlatom/MLatomF_src/Makefile.intel -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,175 copying build/lib/mlatom/MLatomF_src/stopper.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,176 copying build/lib/mlatom/MLatomF_src/molDescr.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,179 copying build/lib/mlatom/MLatomF_src/precision.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,181 copying build/lib/mlatom/MLatomF_src/Makefile -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,183 copying build/lib/mlatom/MLatomF_src/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,185 copying build/lib/mlatom/MLatomF_src/analyze.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,187 copying build/lib/mlatom/MLatomF_src/constants.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,188 copying build/lib/mlatom/MLatomF_src/A_KRR_kernel.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,192 copying build/lib/mlatom/MLatomF_src/MLmodel.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,195 copying build/lib/mlatom/MLatomF_src/MLatomF.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,198 copying build/lib/mlatom/MLatomF_src/D_rel2eq.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,200 copying build/lib/mlatom/MLatomF_src/sampling.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,202 copying build/lib/mlatom/MLatomF_src/optionsModule.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,206 copying build/lib/mlatom/MLatomF_src/timing.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,208 copying build/lib/mlatom/MLatomF_src/cs.cpp -> build/bdist.linux-armv7l/wheel/./mlatom/MLatomF_src 2026-09-11T07:54:09,210 copying build/lib/mlatom/md_cmd.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,213 copying build/lib/mlatom/decorators.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,215 copying build/lib/mlatom/composite_methods.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,217 copying build/lib/mlatom/dens.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,220 copying build/lib/mlatom/args_class.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,222 copying build/lib/mlatom/model_cls.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,226 copying build/lib/mlatom/MLatomF -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,438 copying build/lib/mlatom/models.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,441 copying build/lib/mlatom/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,444 copying build/lib/mlatom/GICnet.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,447 copying build/lib/mlatom/md.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,449 copying build/lib/mlatom/ML_NEA.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,454 copying build/lib/mlatom/MLTPA.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,457 copying build/lib/mlatom/irc.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,460 copying build/lib/mlatom/aiqm2.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,463 copying build/lib/mlatom/kreg_api.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,466 copying build/lib/mlatom/EEEDDDD_descriptor.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:09,470 creating build/bdist.linux-armv7l/wheel/mlatom/interfaces 2026-09-11T07:54:09,471 copying build/lib/mlatom/interfaces/xtb_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,474 copying build/lib/mlatom/interfaces/pyscf_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,476 copying build/lib/mlatom/interfaces/turbomole_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,479 copying build/lib/mlatom/interfaces/gaussian_external.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,482 copying build/lib/mlatom/interfaces/aimnet2_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,484 copying build/lib/mlatom/interfaces/orca_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,487 copying build/lib/mlatom/interfaces/gap_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,490 copying build/lib/mlatom/interfaces/dftd4_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,493 copying build/lib/mlatom/interfaces/sgdml_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,496 copying build/lib/mlatom/interfaces/physnet_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,499 copying build/lib/mlatom/interfaces/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,501 copying build/lib/mlatom/interfaces/mace_methods_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,504 copying build/lib/mlatom/interfaces/geometric_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,506 copying build/lib/mlatom/interfaces/mace_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,510 copying build/lib/mlatom/interfaces/torchani_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,515 copying build/lib/mlatom/interfaces/dftbplus_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,517 copying build/lib/mlatom/interfaces/ase_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,520 copying build/lib/mlatom/interfaces/gaussian_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,523 copying build/lib/mlatom/interfaces/pysisyphus_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,526 copying build/lib/mlatom/interfaces/columbus_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,528 copying build/lib/mlatom/interfaces/dpmd_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,531 copying build/lib/mlatom/interfaces/dftd3_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,533 copying build/lib/mlatom/interfaces/mndo_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:09,536 copying build/lib/mlatom/interfaces/xtb -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:11,082 copying build/lib/mlatom/interfaces/sparrow_interface.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:11,085 copying build/lib/mlatom/interfaces/torchani_heavy_parts.py -> build/bdist.linux-armv7l/wheel/./mlatom/interfaces 2026-09-11T07:54:11,087 copying build/lib/mlatom/thermostat.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,089 copying build/lib/mlatom/log.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,092 creating build/bdist.linux-armv7l/wheel/mlatom/fortran 2026-09-11T07:54:11,094 copying build/lib/mlatom/fortran/mathUtils.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/fortran 2026-09-11T07:54:11,096 copying build/lib/mlatom/fortran/stopper.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/fortran 2026-09-11T07:54:11,098 copying build/lib/mlatom/fortran/KREG.f90 -> build/bdist.linux-armv7l/wheel/./mlatom/fortran 2026-09-11T07:54:11,101 copying build/lib/mlatom/fortran/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/fortran 2026-09-11T07:54:11,103 creating build/bdist.linux-armv7l/wheel/mlatom/fortran/np2 2026-09-11T07:54:11,105 copying build/lib/mlatom/fortran/np2/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/fortran/np2 2026-09-11T07:54:11,107 copying build/lib/mlatom/fortran/np2/KREG.so -> build/bdist.linux-armv7l/wheel/./mlatom/fortran/np2 2026-09-11T07:54:11,140 creating build/bdist.linux-armv7l/wheel/mlatom/fortran/np1 2026-09-11T07:54:11,141 copying build/lib/mlatom/fortran/np1/__init__.py -> build/bdist.linux-armv7l/wheel/./mlatom/fortran/np1 2026-09-11T07:54:11,142 copying build/lib/mlatom/fortran/np1/KREG.so -> build/bdist.linux-armv7l/wheel/./mlatom/fortran/np1 2026-09-11T07:54:11,170 copying build/lib/mlatom/fortran/compile.py -> build/bdist.linux-armv7l/wheel/./mlatom/fortran 2026-09-11T07:54:11,172 copying build/lib/mlatom/doc.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,175 copying build/lib/mlatom/plot.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,178 copying build/lib/mlatom/conversions.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,180 copying build/lib/mlatom/gen_ts_methods.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,182 copying build/lib/mlatom/namd.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,185 copying build/lib/mlatom/omnip1.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,188 copying build/lib/mlatom/_update_check.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,190 copying build/lib/mlatom/data.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,196 copying build/lib/mlatom/_version.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,198 copying build/lib/mlatom/constants.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,200 copying build/lib/mlatom/MLtasks.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,203 copying build/lib/mlatom/header.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,206 copying build/lib/mlatom/_version_static.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,208 copying build/lib/mlatom/md2vibr.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,210 copying build/lib/mlatom/dispersion.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,213 copying build/lib/mlatom/delta_learning.py -> build/bdist.linux-armv7l/wheel/./mlatom 2026-09-11T07:54:11,215 running install_egg_info 2026-09-11T07:54:11,251 running egg_info 2026-09-11T07:54:11,279 writing src/mlatom.egg-info/PKG-INFO 2026-09-11T07:54:11,283 writing dependency_links to src/mlatom.egg-info/dependency_links.txt 2026-09-11T07:54:11,284 writing entry points to src/mlatom.egg-info/entry_points.txt 2026-09-11T07:54:11,286 writing requirements to src/mlatom.egg-info/requires.txt 2026-09-11T07:54:11,288 writing top-level names to src/mlatom.egg-info/top_level.txt 2026-09-11T07:54:11,402 reading manifest file 'src/mlatom.egg-info/SOURCES.txt' 2026-09-11T07:54:11,412 adding license file 'LICENSE.txt' 2026-09-11T07:54:11,421 writing manifest file 'src/mlatom.egg-info/SOURCES.txt' 2026-09-11T07:54:11,423 Copying src/mlatom.egg-info to build/bdist.linux-armv7l/wheel/./mlatom-3.25.4-py3.11.egg-info 2026-09-11T07:54:11,436 running install_scripts 2026-09-11T07:54:11,451 creating build/bdist.linux-armv7l/wheel/mlatom-3.25.4.dist-info/WHEEL 2026-09-11T07:54:11,454 creating '/tmp/pip-wheel-kk1b7dmb/mlatom-3.25.4-py3-none-any.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2026-09-11T07:54:11,461 adding 'mlatom/EEEDDDD.py' 2026-09-11T07:54:11,462 adding 'mlatom/EEEDDDD_descriptor.py' 2026-09-11T07:54:11,464 adding 'mlatom/EEEDDDD_nn.py' 2026-09-11T07:54:11,469 adding 'mlatom/GICnet.py' 2026-09-11T07:54:11,472 adding 'mlatom/MLTPA.py' 2026-09-11T07:54:11,486 adding 'mlatom/ML_NEA.py' 2026-09-11T07:54:11,488 adding 'mlatom/MLatom.py' 2026-09-11T07:54:14,080 adding 'mlatom/MLatomF' 2026-09-11T07:54:14,182 adding 'mlatom/MLtasks.py' 2026-09-11T07:54:14,184 adding 'mlatom/__init__.py' 2026-09-11T07:54:14,186 adding 'mlatom/_update_check.py' 2026-09-11T07:54:14,187 adding 'mlatom/_version.py' 2026-09-11T07:54:14,188 adding 'mlatom/_version_static.py' 2026-09-11T07:54:14,193 adding 'mlatom/aiqm1.py' 2026-09-11T07:54:14,196 adding 'mlatom/aiqm2.py' 2026-09-11T07:54:14,201 adding 'mlatom/al.py' 2026-09-11T07:54:14,211 adding 'mlatom/al_utils.py' 2026-09-11T07:54:14,216 adding 'mlatom/args_class.py' 2026-09-11T07:54:14,218 adding 'mlatom/ccsdtstarcbs.py' 2026-09-11T07:54:14,220 adding 'mlatom/ciopt.py' 2026-09-11T07:54:14,222 adding 'mlatom/composite_methods.py' 2026-09-11T07:54:14,223 adding 'mlatom/constants.py' 2026-09-11T07:54:14,225 adding 'mlatom/conversions.py' 2026-09-11T07:54:14,227 adding 'mlatom/cs.so' 2026-09-11T07:54:14,250 adding 'mlatom/data.py' 2026-09-11T07:54:14,252 adding 'mlatom/decorators.py' 2026-09-11T07:54:14,256 adding 'mlatom/delta_learning.py' 2026-09-11T07:54:14,260 adding 'mlatom/dens.py' 2026-09-11T07:54:14,263 adding 'mlatom/dispersion.py' 2026-09-11T07:54:14,269 adding 'mlatom/doc.py' 2026-09-11T07:54:14,273 adding 'mlatom/functionsGICnet.py' 2026-09-11T07:54:14,275 adding 'mlatom/gap_md.py' 2026-09-11T07:54:14,277 adding 'mlatom/gen_ts_methods.py' 2026-09-11T07:54:14,279 adding 'mlatom/header.py' 2026-09-11T07:54:14,283 adding 'mlatom/initial_conditions.py' 2026-09-11T07:54:14,285 adding 'mlatom/interface_MLatomF.py' 2026-09-11T07:54:14,289 adding 'mlatom/irc.py' 2026-09-11T07:54:14,291 adding 'mlatom/kreg_api.py' 2026-09-11T07:54:14,292 adding 'mlatom/krr_julia.py' 2026-09-11T07:54:14,294 adding 'mlatom/log.py' 2026-09-11T07:54:14,296 adding 'mlatom/md.py' 2026-09-11T07:54:14,298 adding 'mlatom/md2vibr.py' 2026-09-11T07:54:14,300 adding 'mlatom/md2vibr_cmd.py' 2026-09-11T07:54:14,302 adding 'mlatom/md_cmd.py' 2026-09-11T07:54:14,304 adding 'mlatom/md_parallel.py' 2026-09-11T07:54:14,312 adding 'mlatom/mlatom_gui.py' 2026-09-11T07:54:14,318 adding 'mlatom/model_cls.py' 2026-09-11T07:54:14,323 adding 'mlatom/models.py' 2026-09-11T07:54:14,330 adding 'mlatom/namd.py' 2026-09-11T07:54:14,333 adding 'mlatom/omnip1.py' 2026-09-11T07:54:14,336 adding 'mlatom/omnip1_nn.py' 2026-09-11T07:54:14,338 adding 'mlatom/plot.py' 2026-09-11T07:54:14,340 adding 'mlatom/ref.json' 2026-09-11T07:54:14,341 adding 'mlatom/shell_cmd.py' 2026-09-11T07:54:14,347 adding 'mlatom/simulations.py' 2026-09-11T07:54:14,349 adding 'mlatom/sliceData.py' 2026-09-11T07:54:14,355 adding 'mlatom/spectra.py' 2026-09-11T07:54:14,357 adding 'mlatom/stats.py' 2026-09-11T07:54:14,358 adding 'mlatom/stopper.py' 2026-09-11T07:54:14,360 adding 'mlatom/thermostat.py' 2026-09-11T07:54:14,362 adding 'mlatom/universal_mlips.py' 2026-09-11T07:54:14,364 adding 'mlatom/utils.py' 2026-09-11T07:54:14,365 adding 'mlatom/xyz.py' 2026-09-11T07:54:14,372 adding 'mlatom/MLatomF_src/A_KRR.f90' 2026-09-11T07:54:14,379 adding 'mlatom/MLatomF_src/A_KRR_kernel.f90' 2026-09-11T07:54:14,381 adding 'mlatom/MLatomF_src/D_CoulombMatrix.f90' 2026-09-11T07:54:14,382 adding 'mlatom/MLatomF_src/D_ID.f90' 2026-09-11T07:54:14,384 adding 'mlatom/MLatomF_src/D_rel2eq.f90' 2026-09-11T07:54:14,386 adding 'mlatom/MLatomF_src/MLatomF.f90' 2026-09-11T07:54:14,387 adding 'mlatom/MLatomF_src/MLatomFInfo.f90' 2026-09-11T07:54:14,391 adding 'mlatom/MLatomF_src/MLmodel.f90' 2026-09-11T07:54:14,392 adding 'mlatom/MLatomF_src/Makefile' 2026-09-11T07:54:14,394 adding 'mlatom/MLatomF_src/Makefile.intel' 2026-09-11T07:54:14,395 adding 'mlatom/MLatomF_src/__init__.py' 2026-09-11T07:54:14,396 adding 'mlatom/MLatomF_src/analyze.f90' 2026-09-11T07:54:14,397 adding 'mlatom/MLatomF_src/constants.f90' 2026-09-11T07:54:14,399 adding 'mlatom/MLatomF_src/cs.cpp' 2026-09-11T07:54:14,405 adding 'mlatom/MLatomF_src/dataset.f90' 2026-09-11T07:54:14,408 adding 'mlatom/MLatomF_src/mathUtils.f90' 2026-09-11T07:54:14,411 adding 'mlatom/MLatomF_src/molDescr.f90' 2026-09-11T07:54:14,417 adding 'mlatom/MLatomF_src/optionsModule.f90' 2026-09-11T07:54:14,419 adding 'mlatom/MLatomF_src/precision.f90' 2026-09-11T07:54:14,420 adding 'mlatom/MLatomF_src/recover.sh' 2026-09-11T07:54:14,422 adding 'mlatom/MLatomF_src/sampling.f90' 2026-09-11T07:54:14,424 adding 'mlatom/MLatomF_src/statistics.f90' 2026-09-11T07:54:14,425 adding 'mlatom/MLatomF_src/stopper.f90' 2026-09-11T07:54:14,427 adding 'mlatom/MLatomF_src/strings.f90' 2026-09-11T07:54:14,428 adding 'mlatom/MLatomF_src/timing.f90' 2026-09-11T07:54:14,429 adding 'mlatom/MLatomF_src/types.f90' 2026-09-11T07:54:14,431 adding 'mlatom/addons/__init__.py' 2026-09-11T07:54:14,432 adding 'mlatom/addons/aiqm3/__init__.py' 2026-09-11T07:54:14,434 adding 'mlatom/addons/aiqm3/aiqm3.py' 2026-09-11T07:54:14,436 adding 'mlatom/addons/omnip2x/__init__.py' 2026-09-11T07:54:14,438 adding 'mlatom/addons/omnip2x/omnip2x.py' 2026-09-11T07:54:14,439 adding 'mlatom/addons/omnip2x/re_state_input_net.py' 2026-09-11T07:54:14,445 adding 'mlatom/addons/omnip2x/vecmsani.py' 2026-09-11T07:54:14,447 adding 'mlatom/addons/uaiqm/__init__.py' 2026-09-11T07:54:14,448 adding 'mlatom/addons/uaiqm/uaiqm.py' 2026-09-11T07:54:14,452 adding 'mlatom/fortran/KREG.f90' 2026-09-11T07:54:14,453 adding 'mlatom/fortran/__init__.py' 2026-09-11T07:54:14,454 adding 'mlatom/fortran/compile.py' 2026-09-11T07:54:14,455 adding 'mlatom/fortran/mathUtils.f90' 2026-09-11T07:54:14,457 adding 'mlatom/fortran/stopper.f90' 2026-09-11T07:54:14,666 adding 'mlatom/fortran/np1/KREG.so' 2026-09-11T07:54:14,676 adding 'mlatom/fortran/np1/__init__.py' 2026-09-11T07:54:14,890 adding 'mlatom/fortran/np2/KREG.so' 2026-09-11T07:54:14,900 adding 'mlatom/fortran/np2/__init__.py' 2026-09-11T07:54:14,902 adding 'mlatom/interfaces/__init__.py' 2026-09-11T07:54:14,903 adding 'mlatom/interfaces/aimnet2_interface.py' 2026-09-11T07:54:14,906 adding 'mlatom/interfaces/ase_interface.py' 2026-09-11T07:54:14,908 adding 'mlatom/interfaces/columbus_interface.py' 2026-09-11T07:54:14,910 adding 'mlatom/interfaces/dftbplus_interface.py' 2026-09-11T07:54:14,912 adding 'mlatom/interfaces/dftd3_interface.py' 2026-09-11T07:54:14,913 adding 'mlatom/interfaces/dftd4_interface.py' 2026-09-11T07:54:14,916 adding 'mlatom/interfaces/dpmd_interface.py' 2026-09-11T07:54:14,918 adding 'mlatom/interfaces/gap_interface.py' 2026-09-11T07:54:14,919 adding 'mlatom/interfaces/gaussian_external.py' 2026-09-11T07:54:14,926 adding 'mlatom/interfaces/gaussian_interface.py' 2026-09-11T07:54:14,928 adding 'mlatom/interfaces/geometric_interface.py' 2026-09-11T07:54:14,932 adding 'mlatom/interfaces/mace_interface.py' 2026-09-11T07:54:14,934 adding 'mlatom/interfaces/mace_methods_interface.py' 2026-09-11T07:54:14,937 adding 'mlatom/interfaces/mndo_interface.py' 2026-09-11T07:54:14,943 adding 'mlatom/interfaces/orca_interface.py' 2026-09-11T07:54:14,947 adding 'mlatom/interfaces/physnet_interface.py' 2026-09-11T07:54:14,951 adding 'mlatom/interfaces/pyscf_interface.py' 2026-09-11T07:54:14,953 adding 'mlatom/interfaces/pysisyphus_interface.py' 2026-09-11T07:54:14,958 adding 'mlatom/interfaces/sgdml_interface.py' 2026-09-11T07:54:14,960 adding 'mlatom/interfaces/sparrow_interface.py' 2026-09-11T07:54:14,961 adding 'mlatom/interfaces/torchani_heavy_parts.py' 2026-09-11T07:54:14,975 adding 'mlatom/interfaces/torchani_interface.py' 2026-09-11T07:54:14,978 adding 'mlatom/interfaces/turbomole_interface.py' 2026-09-11T07:54:23,141 adding 'mlatom/interfaces/xtb' 2026-09-11T07:54:23,536 adding 'mlatom/interfaces/xtb_interface.py' 2026-09-11T07:54:23,539 adding 'mlatom/julia/KREG.jl' 2026-09-11T07:54:23,540 adding 'mlatom/julia/__init__.py' 2026-09-11T07:54:23,541 adding 'mlatom/julia/kernel_function.jl' 2026-09-11T07:54:23,543 adding 'mlatom/julia/kreg_julia.py' 2026-09-11T07:54:23,545 adding 'mlatom/julia/krr.jl' 2026-09-11T07:54:23,546 adding 'mlatom/julia/mathUtils.jl' 2026-09-11T07:54:23,547 adding 'mlatom/julia/stopper.jl' 2026-09-11T07:54:23,549 adding 'mlatom/mlatom_models/__init__.py' 2026-09-11T07:54:23,550 adding 'mlatom/mlatom_models/aiqm1_model/__init__.py' 2026-09-11T07:54:23,809 adding 'mlatom/mlatom_models/aiqm1_model/cv0.pt' 2026-09-11T07:54:24,080 adding 'mlatom/mlatom_models/aiqm1_model/cv1.pt' 2026-09-11T07:54:24,351 adding 'mlatom/mlatom_models/aiqm1_model/cv2.pt' 2026-09-11T07:54:24,620 adding 'mlatom/mlatom_models/aiqm1_model/cv3.pt' 2026-09-11T07:54:24,891 adding 'mlatom/mlatom_models/aiqm1_model/cv4.pt' 2026-09-11T07:54:25,161 adding 'mlatom/mlatom_models/aiqm1_model/cv5.pt' 2026-09-11T07:54:25,432 adding 'mlatom/mlatom_models/aiqm1_model/cv6.pt' 2026-09-11T07:54:25,703 adding 'mlatom/mlatom_models/aiqm1_model/cv7.pt' 2026-09-11T07:54:25,732 adding 'mlatom/mlatom_models/aiqm2_model/__init__.py' 2026-09-11T07:54:26,116 adding 'mlatom/mlatom_models/aiqm2_model/cv0.pt' 2026-09-11T07:54:26,516 adding 'mlatom/mlatom_models/aiqm2_model/cv1.pt' 2026-09-11T07:54:26,916 adding 'mlatom/mlatom_models/aiqm2_model/cv2.pt' 2026-09-11T07:54:27,317 adding 'mlatom/mlatom_models/aiqm2_model/cv3.pt' 2026-09-11T07:54:27,769 adding 'mlatom/mlatom_models/aiqm2_model/cv4.pt' 2026-09-11T07:54:28,169 adding 'mlatom/mlatom_models/aiqm2_model/cv5.pt' 2026-09-11T07:54:28,569 adding 'mlatom/mlatom_models/aiqm2_model/cv6.pt' 2026-09-11T07:54:28,996 adding 'mlatom/mlatom_models/aiqm2_model/cv7.pt' 2026-09-11T07:54:29,015 adding 'mlatom/mltpa/__init__.py' 2026-09-11T07:54:29,017 adding 'mlatom/mltpa/mff.txt' 2026-09-11T07:54:29,621 adding 'mlatom/mltpa/mltpa2022_2.pkl' 2026-09-11T07:54:30,000 adding 'mlatom/mltpa/mltpa2022_2_new_.pkl' 2026-09-11T07:54:30,017 adding 'mlatom-3.25.4.dist-info/licenses/LICENSE.txt' 2026-09-11T07:54:30,019 adding 'mlatom-3.25.4.dist-info/METADATA' 2026-09-11T07:54:30,020 adding 'mlatom-3.25.4.dist-info/WHEEL' 2026-09-11T07:54:30,021 adding 'mlatom-3.25.4.dist-info/entry_points.txt' 2026-09-11T07:54:30,022 adding 'mlatom-3.25.4.dist-info/top_level.txt' 2026-09-11T07:54:30,024 adding 'mlatom-3.25.4.dist-info/RECORD' 2026-09-11T07:54:30,497 removing build/bdist.linux-armv7l/wheel 2026-09-11T07:54:30,686 Building wheel for mlatom (setup.py): finished with status 'done' 2026-09-11T07:54:31,296 Created wheel for mlatom: filename=mlatom-3.25.4-py3-none-any.whl size=62082462 sha256=2681cc09095a11115c177b18ade9b0b2e9bac91cd3dfc1274f8659fd80d0b1e7 2026-09-11T07:54:31,297 Stored in directory: /tmp/pip-ephem-wheel-cache-q0lsw8ca/wheels/e4/17/70/c12560bbdfc1aeafc9d005192f4b93f63da75e08278d648af5 2026-09-11T07:54:31,333 Successfully built mlatom 2026-09-11T07:54:32,768 Removed build tracker: '/tmp/pip-build-tracker-hhc4bwvb'