2026-03-05T01:07:13,768 Created temporary directory: /tmp/pip-ephem-wheel-cache-zeplnysi 2026-03-05T01:07:13,770 Created temporary directory: /tmp/pip-build-tracker-zw6keqef 2026-03-05T01:07:13,771 Initialized build tracking at /tmp/pip-build-tracker-zw6keqef 2026-03-05T01:07:13,771 Created build tracker: /tmp/pip-build-tracker-zw6keqef 2026-03-05T01:07:13,771 Entered build tracker: /tmp/pip-build-tracker-zw6keqef 2026-03-05T01:07:13,772 Created temporary directory: /tmp/pip-wheel-ecqkxvtb 2026-03-05T01:07:13,775 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 2026-03-05T01:07:13,777 Created temporary directory: /tmp/pip-ephem-wheel-cache-uby57pe4 2026-03-05T01:07:13,799 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2026-03-05T01:07:13,802 2 location(s) to search for versions of nequip: 2026-03-05T01:07:13,802 * https://pypi.org/simple/nequip/ 2026-03-05T01:07:13,802 * https://www.piwheels.org/simple/nequip/ 2026-03-05T01:07:13,803 Fetching project page and analyzing links: https://pypi.org/simple/nequip/ 2026-03-05T01:07:13,804 Getting page https://pypi.org/simple/nequip/ 2026-03-05T01:07:13,805 Found index url https://pypi.org/simple 2026-03-05T01:07:13,939 Fetched page https://pypi.org/simple/nequip/ as application/vnd.pypi.simple.v1+json 2026-03-05T01:07:13,948 Skipping link: No binaries permitted for nequip: 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2026-03-05T01:07:13,955 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/a8/61/af868b7e7efc0ee8903a13dcedfd0f7502ee93c392ae06f09fa854f49c78/nequip-0.6.1-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.7) 2026-03-05T01:07:13,956 Found link https://files.pythonhosted.org/packages/d6/25/4eb741d44009b07cca714546600c4dc65adfed77b2b3c26e92c078c58e66/nequip-0.6.1.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.7), version: 0.6.1 2026-03-05T01:07:13,957 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/ad/fb/804906e81617e7abd0f12c2f62865524fc4f47601d66b623d7d4347f4957/nequip-0.6.2-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.7) 2026-03-05T01:07:13,958 Found link https://files.pythonhosted.org/packages/00/df/a99c9ad2ff3cd2c933f5e48d2a7da3e86f35177242d7e5ead92c0d3b6f87/nequip-0.6.2.tar.gz (from https://pypi.org/simple/nequip/) 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2026-03-05T01:07:13,967 Found link https://files.pythonhosted.org/packages/12/db/5b1f03fcc88a292742f10acdfe2dcf2750917f90bca34051ac5c0bdb1391/nequip-0.10.0.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.9), version: 0.10.0 2026-03-05T01:07:13,967 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/71/cf/d3931e2242b1cd04580b74650889539d04c66246b34299e4cd3364018075/nequip-0.11.0-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.9) 2026-03-05T01:07:13,968 Found link https://files.pythonhosted.org/packages/02/56/203d14c2e2134ff6a0f02eac9a9492a139ff9891cc357be504e9e32229cd/nequip-0.11.0.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.9), version: 0.11.0 2026-03-05T01:07:13,969 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/da/30/52ab9c374224f7e5419560aadf5446e2604b6839530b58a604ec2d80c887/nequip-0.11.1-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.9) 2026-03-05T01:07:13,970 Found link https://files.pythonhosted.org/packages/db/30/e0a9d52f9051af60c8f5968fd7bac7ec0b07ec2577862e2fa12017e88157/nequip-0.11.1.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.9), version: 0.11.1 2026-03-05T01:07:13,971 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/cc/af/4ce108725e5ae07079b4a062f2114bc0dbb45244abd5ef0e76c9d45afc5c/nequip-0.12.0-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:13,972 Found link https://files.pythonhosted.org/packages/99/f2/27ac6a3826dd8310bf72d84075e1005ab1ac3d5132951481e8e5112d169e/nequip-0.12.0.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.10), version: 0.12.0 2026-03-05T01:07:13,972 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/0b/d3/5dc6ba97edbd8c62f3225e694c0539a45026f97c91c3b9f98b49803c6249/nequip-0.12.1-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:13,973 Found link https://files.pythonhosted.org/packages/c0/20/e3a265282bdf9b0d70a3ce147aa1a2f0ba7d0697bf20b46ade28fb206655/nequip-0.12.1.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.10), version: 0.12.1 2026-03-05T01:07:13,974 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/26/d7/2edb7410920b562453a8fa07098b0aee698e66914d4eadf42ffed6aceb2e/nequip-0.13.0-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:13,974 Found link https://files.pythonhosted.org/packages/b1/94/739d979e6819bfce61ad4d1608fc362c95de5ce6cba042b4e57114897db5/nequip-0.13.0.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.10), version: 0.13.0 2026-03-05T01:07:13,975 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/03/15/1538cb72b979149844bef93be81f85d660f0e5cb48970a94f26088ca1698/nequip-0.14.0-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:13,976 Found link https://files.pythonhosted.org/packages/d0/34/e7c643fa74b03dfeb5bcb9f8231277b55033d1262455202169974584f5e6/nequip-0.14.0.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.10), version: 0.14.0 2026-03-05T01:07:13,977 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/21/2f/568ceb24298c7cfc86b53da35fee030c7f35cd9399a9b456709f626adc33/nequip-0.15.0-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:13,978 Found link https://files.pythonhosted.org/packages/e2/bc/0a04273148cc07d3e61b93333968622d47023c8e0a07e4a0bf76a3865549/nequip-0.15.0.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.10), version: 0.15.0 2026-03-05T01:07:13,978 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/16/84/f8ca37be5ba6dd6a1a42f52194906552f6a439a1093544652f00938301cb/nequip-0.16.0-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:13,979 Found link https://files.pythonhosted.org/packages/16/ec/39e9e66768d121cbffcfada6a58c57a891cbed5398400562ace9d06adcd1/nequip-0.16.0.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.10), version: 0.16.0 2026-03-05T01:07:13,980 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/25/75/5cda4d3c94a02e2e33eaaf3f2acda93bbbe16fba669fd60ed95f11d25192/nequip-0.16.1-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:13,981 Found link https://files.pythonhosted.org/packages/57/a9/46f1f5d719ac1e5cdfb43974a108ecb618ae34383edfcb0072fed81b5a75/nequip-0.16.1.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.10), version: 0.16.1 2026-03-05T01:07:13,982 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/e5/27/f0a81f23f78225e9ec0d482eb871414f536226a8c06824cf0d30530060b0/nequip-0.16.2-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:13,983 Found link https://files.pythonhosted.org/packages/43/2e/0dd686b93e8cc73ea1364f518c75c3022df89ad90b3cee8fba03966511a1/nequip-0.16.2.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.10), version: 0.16.2 2026-03-05T01:07:13,983 Skipping link: No binaries permitted for nequip: https://files.pythonhosted.org/packages/b8/08/6cd848d66fd71803fe15f5c47d36acdda049e8bb1dd858968daea9629b35/nequip-0.17.0-py3-none-any.whl (from https://pypi.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:13,984 Found link https://files.pythonhosted.org/packages/a8/4b/896cfb371f9ab4b7bb4fe9deb846704d84bb083b1956c772c70aa9802c22/nequip-0.17.0.tar.gz (from https://pypi.org/simple/nequip/) (requires-python:>=3.10), version: 0.17.0 2026-03-05T01:07:13,985 Fetching project page and analyzing links: https://www.piwheels.org/simple/nequip/ 2026-03-05T01:07:13,985 Getting page https://www.piwheels.org/simple/nequip/ 2026-03-05T01:07:13,987 Found index url https://www.piwheels.org/simple 2026-03-05T01:07:14,144 Fetched page https://www.piwheels.org/simple/nequip/ as text/html 2026-03-05T01:07:14,151 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.16.2-py3-none-any.whl#sha256=48535b2dd31df9dc30087bea0224857d3850254070ba2bb99281a9a653ba3882 (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:14,152 Skipping link: No binaries permitted for nequip: 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https://archive1.piwheels.org/simple/nequip/nequip-0.12.0-py3-none-any.whl#sha256=03ed3bd76d048c429105ee667165aa877b92b2a82e66b34f84d1a2d6967c700b (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.10) 2026-03-05T01:07:14,156 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.11.1-py3-none-any.whl#sha256=c5b2e1d0032455d3e4785b640d1b1461e85576edde65602741dcfe52996855e2 (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.9) 2026-03-05T01:07:14,157 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.11.0-py3-none-any.whl#sha256=f86f138fce16fb78905b6c24090ef821bc42d74a52b3bc2aa3bea84dae628cb9 (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.9) 2026-03-05T01:07:14,158 Skipping link: No binaries permitted for nequip: 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https://archive1.piwheels.org/simple/nequip/nequip-0.8.0-py3-none-any.whl#sha256=9c9f212b96f9b3b469a9b7f5c6635a6a403dad76b0aff1a52ea19d93961d0ccf (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.9) 2026-03-05T01:07:14,159 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.7.1-py3-none-any.whl#sha256=af00b6af667d7b3b3da572f0e22630399a2b32adeae89bf6ef98cad6ae88c29e (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.9) 2026-03-05T01:07:14,160 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.7.0-py3-none-any.whl#sha256=87e43733773b14ee89acd42b4995db0ad46859a07aa3cdba30dfb61778ac2c26 (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.9) 2026-03-05T01:07:14,161 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.6.2-py3-none-any.whl#sha256=275b762b07a3148e6e4941154d38ff0d58e09159e96ac874964b6c18e414b5b8 (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.7) 2026-03-05T01:07:14,161 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.6.1-py3-none-any.whl#sha256=8ec156d34287fff4544af1b841a2938853bafbe759bf8fd64a157e80f1ac5eee (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.7) 2026-03-05T01:07:14,162 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.6.0-py3-none-any.whl#sha256=a42a4ec30cf872ddd5e392b241061c25a046aed0f0bf6e9dca8b08f52012b8b4 (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.7) 2026-03-05T01:07:14,163 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.5.6-py3-none-any.whl#sha256=0ae4cee4decfd2b9aa49f9adb7d98f6186703dee6208e618fbd79156323c857f (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.7) 2026-03-05T01:07:14,163 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.5.5-py3-none-any.whl#sha256=9d7dbd0ab0c98a98f4dd8f6027008be5717e3d7273d195f057a94209d0deaa5d (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.7) 2026-03-05T01:07:14,164 Skipping link: No binaries permitted for nequip: https://archive1.piwheels.org/simple/nequip/nequip-0.5.4-py3-none-any.whl#sha256=3525070925db5a358ffcb58c979bf3699352eb1352c33de1bb163389f0683256 (from https://www.piwheels.org/simple/nequip/) (requires-python:>=3.7) 2026-03-05T01:07:14,165 Skipping link: not a file: https://www.piwheels.org/simple/nequip/ 2026-03-05T01:07:14,165 Skipping link: not a file: https://pypi.org/simple/nequip/ 2026-03-05T01:07:14,189 Given no hashes to check 1 links for project 'nequip': discarding no candidates 2026-03-05T01:07:14,208 Collecting nequip==0.17.0 2026-03-05T01:07:14,210 Created temporary directory: /tmp/pip-unpack-ifs_a09z 2026-03-05T01:07:14,342 Downloading nequip-0.17.0.tar.gz (227 kB) 2026-03-05T01:07:14,713 Added nequip==0.17.0 from https://files.pythonhosted.org/packages/a8/4b/896cfb371f9ab4b7bb4fe9deb846704d84bb083b1956c772c70aa9802c22/nequip-0.17.0.tar.gz to build tracker '/tmp/pip-build-tracker-zw6keqef' 2026-03-05T01:07:14,719 Created temporary directory: /tmp/pip-build-env-g3sim46o 2026-03-05T01:07:14,724 Installing build dependencies: started 2026-03-05T01:07:14,725 Running command pip subprocess to install build dependencies 2026-03-05T01:07:15,853 Using pip 23.0.1 from /usr/lib/python3/dist-packages/pip (python 3.11) 2026-03-05T01:07:16,434 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 2026-03-05T01:07:16,457 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2026-03-05T01:07:18,257 Collecting setuptools>=45 2026-03-05T01:07:18,341 Using cached https://www.piwheels.org/simple/setuptools/setuptools-82.0.0-py3-none-any.whl (1.0 MB) 2026-03-05T01:07:18,618 Collecting wheel 2026-03-05T01:07:18,632 Using cached https://www.piwheels.org/simple/wheel/wheel-0.46.3-py3-none-any.whl (30 kB) 2026-03-05T01:07:18,822 Collecting packaging>=24.0 2026-03-05T01:07:18,841 Using cached https://www.piwheels.org/simple/packaging/packaging-26.0-py3-none-any.whl (74 kB) 2026-03-05T01:07:22,078 Installing collected packages: setuptools, packaging, wheel 2026-03-05T01:07:25,403 Creating /tmp/pip-build-env-g3sim46o/overlay/local/bin 2026-03-05T01:07:25,405 changing mode of /tmp/pip-build-env-g3sim46o/overlay/local/bin/wheel to 755 2026-03-05T01:07:25,426 Successfully installed packaging-26.0 setuptools-82.0.0 wheel-0.46.3 2026-03-05T01:07:25,705 Installing build dependencies: finished with status 'done' 2026-03-05T01:07:25,712 Getting requirements to build wheel: started 2026-03-05T01:07:25,713 Running command Getting requirements to build wheel 2026-03-05T01:07:26,328 /tmp/pip-build-env-g3sim46o/overlay/local/lib/python3.11/dist-packages/setuptools/config/_apply_pyprojecttoml.py:82: SetuptoolsDeprecationWarning: `project.license` as a TOML table is deprecated 2026-03-05T01:07:26,328 !! 2026-03-05T01:07:26,329 ******************************************************************************** 2026-03-05T01:07:26,330 Please use a simple string containing a SPDX expression for `project.license`. You can also use `project.license-files`. (Both options available on setuptools>=77.0.0). 2026-03-05T01:07:26,331 By 2027-Feb-18, you need to update your project and remove deprecated calls 2026-03-05T01:07:26,331 or your builds will no longer be supported. 2026-03-05T01:07:26,332 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-05T01:07:26,333 ******************************************************************************** 2026-03-05T01:07:26,334 !! 2026-03-05T01:07:26,335 corresp(dist, value, root_dir) 2026-03-05T01:07:26,415 running egg_info 2026-03-05T01:07:26,421 writing nequip.egg-info/PKG-INFO 2026-03-05T01:07:26,424 writing dependency_links to nequip.egg-info/dependency_links.txt 2026-03-05T01:07:26,426 writing entry points to nequip.egg-info/entry_points.txt 2026-03-05T01:07:26,429 writing requirements to nequip.egg-info/requires.txt 2026-03-05T01:07:26,430 writing top-level names to nequip.egg-info/top_level.txt 2026-03-05T01:07:26,473 reading manifest file 'nequip.egg-info/SOURCES.txt' 2026-03-05T01:07:26,483 adding license file 'LICENSE' 2026-03-05T01:07:26,483 adding license file 'AUTHORS.md' 2026-03-05T01:07:26,491 writing manifest file 'nequip.egg-info/SOURCES.txt' 2026-03-05T01:07:26,589 Getting requirements to build wheel: finished with status 'done' 2026-03-05T01:07:26,592 Created temporary directory: /tmp/pip-modern-metadata-an3seqhx 2026-03-05T01:07:26,595 Preparing metadata (pyproject.toml): started 2026-03-05T01:07:26,596 Running command Preparing metadata (pyproject.toml) 2026-03-05T01:07:27,690 /tmp/pip-build-env-g3sim46o/overlay/local/lib/python3.11/dist-packages/setuptools/config/_apply_pyprojecttoml.py:82: SetuptoolsDeprecationWarning: `project.license` as a TOML table is deprecated 2026-03-05T01:07:27,690 !! 2026-03-05T01:07:27,691 ******************************************************************************** 2026-03-05T01:07:27,692 Please use a simple string containing a SPDX expression for `project.license`. You can also use `project.license-files`. (Both options available on setuptools>=77.0.0). 2026-03-05T01:07:27,693 By 2027-Feb-18, you need to update your project and remove deprecated calls 2026-03-05T01:07:27,693 or your builds will no longer be supported. 2026-03-05T01:07:27,694 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-05T01:07:27,694 ******************************************************************************** 2026-03-05T01:07:27,695 !! 2026-03-05T01:07:27,696 corresp(dist, value, root_dir) 2026-03-05T01:07:27,776 running dist_info 2026-03-05T01:07:27,786 creating /tmp/pip-modern-metadata-an3seqhx/nequip.egg-info 2026-03-05T01:07:27,787 writing /tmp/pip-modern-metadata-an3seqhx/nequip.egg-info/PKG-INFO 2026-03-05T01:07:27,790 writing dependency_links to /tmp/pip-modern-metadata-an3seqhx/nequip.egg-info/dependency_links.txt 2026-03-05T01:07:27,792 writing entry points to /tmp/pip-modern-metadata-an3seqhx/nequip.egg-info/entry_points.txt 2026-03-05T01:07:27,794 writing requirements to /tmp/pip-modern-metadata-an3seqhx/nequip.egg-info/requires.txt 2026-03-05T01:07:27,796 writing top-level names to /tmp/pip-modern-metadata-an3seqhx/nequip.egg-info/top_level.txt 2026-03-05T01:07:27,797 writing manifest file '/tmp/pip-modern-metadata-an3seqhx/nequip.egg-info/SOURCES.txt' 2026-03-05T01:07:27,835 reading manifest file '/tmp/pip-modern-metadata-an3seqhx/nequip.egg-info/SOURCES.txt' 2026-03-05T01:07:27,837 adding license file 'LICENSE' 2026-03-05T01:07:27,838 adding license file 'AUTHORS.md' 2026-03-05T01:07:27,844 writing manifest file '/tmp/pip-modern-metadata-an3seqhx/nequip.egg-info/SOURCES.txt' 2026-03-05T01:07:27,846 creating '/tmp/pip-modern-metadata-an3seqhx/nequip-0.17.0.dist-info' 2026-03-05T01:07:27,972 Preparing metadata (pyproject.toml): finished with status 'done' 2026-03-05T01:07:27,977 Source in /tmp/pip-wheel-ecqkxvtb/nequip_55139cd053024f06a4b725dc3c073d55 has version 0.17.0, which satisfies requirement nequip==0.17.0 from https://files.pythonhosted.org/packages/a8/4b/896cfb371f9ab4b7bb4fe9deb846704d84bb083b1956c772c70aa9802c22/nequip-0.17.0.tar.gz 2026-03-05T01:07:27,978 Removed nequip==0.17.0 from https://files.pythonhosted.org/packages/a8/4b/896cfb371f9ab4b7bb4fe9deb846704d84bb083b1956c772c70aa9802c22/nequip-0.17.0.tar.gz from build tracker '/tmp/pip-build-tracker-zw6keqef' 2026-03-05T01:07:27,985 Created temporary directory: /tmp/pip-unpack-x0tok6bv 2026-03-05T01:07:27,985 Building wheels for collected packages: nequip 2026-03-05T01:07:27,990 Created temporary directory: /tmp/pip-wheel-85zqevyo 2026-03-05T01:07:27,990 Destination directory: /tmp/pip-wheel-85zqevyo 2026-03-05T01:07:27,993 Building wheel for nequip (pyproject.toml): started 2026-03-05T01:07:27,994 Running command Building wheel for nequip (pyproject.toml) 2026-03-05T01:07:28,574 /tmp/pip-build-env-g3sim46o/overlay/local/lib/python3.11/dist-packages/setuptools/config/_apply_pyprojecttoml.py:82: SetuptoolsDeprecationWarning: `project.license` as a TOML table is deprecated 2026-03-05T01:07:28,574 !! 2026-03-05T01:07:28,575 ******************************************************************************** 2026-03-05T01:07:28,575 Please use a simple string containing a SPDX expression for `project.license`. You can also use `project.license-files`. (Both options available on setuptools>=77.0.0). 2026-03-05T01:07:28,576 By 2027-Feb-18, you need to update your project and remove deprecated calls 2026-03-05T01:07:28,577 or your builds will no longer be supported. 2026-03-05T01:07:28,578 See https://packaging.python.org/en/latest/guides/writing-pyproject-toml/#license for details. 2026-03-05T01:07:28,578 ******************************************************************************** 2026-03-05T01:07:28,579 !! 2026-03-05T01:07:28,579 corresp(dist, value, root_dir) 2026-03-05T01:07:28,647 running bdist_wheel 2026-03-05T01:07:28,664 running build 2026-03-05T01:07:28,665 running build_py 2026-03-05T01:07:28,671 creating build/lib/nequip 2026-03-05T01:07:28,672 copying nequip/__init__.py -> build/lib/nequip 2026-03-05T01:07:28,674 copying nequip/_version.py -> build/lib/nequip 2026-03-05T01:07:28,677 creating build/lib/nequip/model 2026-03-05T01:07:28,678 copying nequip/model/utils.py -> build/lib/nequip/model 2026-03-05T01:07:28,680 copying nequip/model/__init__.py -> build/lib/nequip/model 2026-03-05T01:07:28,682 copying nequip/model/pair_potential.py -> build/lib/nequip/model 2026-03-05T01:07:28,683 copying nequip/model/modify_utils.py -> build/lib/nequip/model 2026-03-05T01:07:28,686 copying nequip/model/nequip_models.py -> build/lib/nequip/model 2026-03-05T01:07:28,689 creating build/lib/nequip/utils 2026-03-05T01:07:28,690 copying nequip/utils/compile.py -> build/lib/nequip/utils 2026-03-05T01:07:28,692 copying nequip/utils/modules.py -> build/lib/nequip/utils 2026-03-05T01:07:28,693 copying nequip/utils/fx.py -> build/lib/nequip/utils 2026-03-05T01:07:28,696 copying nequip/utils/resolvers.py -> build/lib/nequip/utils 2026-03-05T01:07:28,698 copying nequip/utils/global_state.py -> build/lib/nequip/utils 2026-03-05T01:07:28,700 copying nequip/utils/aoti_metadata.py -> build/lib/nequip/utils 2026-03-05T01:07:28,702 copying nequip/utils/dtype.py -> build/lib/nequip/utils 2026-03-05T01:07:28,704 copying nequip/utils/model_repository.py -> build/lib/nequip/utils 2026-03-05T01:07:28,706 copying nequip/utils/aot.py -> build/lib/nequip/utils 2026-03-05T01:07:28,708 copying nequip/utils/logger.py -> build/lib/nequip/utils 2026-03-05T01:07:28,709 copying nequip/utils/__init__.py -> build/lib/nequip/utils 2026-03-05T01:07:28,711 copying nequip/utils/test.py -> build/lib/nequip/utils 2026-03-05T01:07:28,714 copying nequip/utils/model_cache.py -> build/lib/nequip/utils 2026-03-05T01:07:28,716 copying nequip/utils/file_utils.py -> build/lib/nequip/utils 2026-03-05T01:07:28,718 copying nequip/utils/global_dtype.py -> build/lib/nequip/utils 2026-03-05T01:07:28,720 creating build/lib/nequip/data 2026-03-05T01:07:28,721 copying nequip/data/AtomicDataDict.py -> build/lib/nequip/data 2026-03-05T01:07:28,724 copying nequip/data/_keys.py -> build/lib/nequip/data 2026-03-05T01:07:28,726 copying nequip/data/_key_registry.py -> build/lib/nequip/data 2026-03-05T01:07:28,728 copying nequip/data/ase.py -> build/lib/nequip/data 2026-03-05T01:07:28,731 copying nequip/data/dict.py -> build/lib/nequip/data 2026-03-05T01:07:28,733 copying nequip/data/__init__.py -> build/lib/nequip/data 2026-03-05T01:07:28,735 copying nequip/data/stats_manager.py -> build/lib/nequip/data 2026-03-05T01:07:28,737 copying nequip/data/_sampler.py -> build/lib/nequip/data 2026-03-05T01:07:28,740 copying nequip/data/misc.py -> build/lib/nequip/data 2026-03-05T01:07:28,741 copying nequip/data/stats.py -> build/lib/nequip/data 2026-03-05T01:07:28,744 copying nequip/data/modifier.py -> build/lib/nequip/data 2026-03-05T01:07:28,746 copying nequip/data/_nl.py -> build/lib/nequip/data 2026-03-05T01:07:28,748 creating build/lib/nequip/ase 2026-03-05T01:07:28,749 copying nequip/ase/__init__.py -> build/lib/nequip/ase 2026-03-05T01:07:28,751 copying nequip/ase/nequip_calculator.py -> build/lib/nequip/ase 2026-03-05T01:07:28,752 copying nequip/ase/nosehoover.py -> build/lib/nequip/ase 2026-03-05T01:07:28,755 creating build/lib/nequip/scripts 2026-03-05T01:07:28,756 copying nequip/scripts/compile.py -> build/lib/nequip/scripts 2026-03-05T01:07:28,758 copying nequip/scripts/_compile_utils.py -> build/lib/nequip/scripts 2026-03-05T01:07:28,760 copying nequip/scripts/package.py -> build/lib/nequip/scripts 2026-03-05T01:07:28,762 copying nequip/scripts/train.py -> build/lib/nequip/scripts 2026-03-05T01:07:28,765 copying nequip/scripts/_workflow_utils.py -> build/lib/nequip/scripts 2026-03-05T01:07:28,766 copying nequip/scripts/__init__.py -> build/lib/nequip/scripts 2026-03-05T01:07:28,768 copying nequip/scripts/_package_utils.py -> build/lib/nequip/scripts 2026-03-05T01:07:28,770 creating build/lib/nequip/nn 2026-03-05T01:07:28,771 copying nequip/nn/compile.py -> build/lib/nequip/nn 2026-03-05T01:07:28,774 copying nequip/nn/nonlinearities.py -> build/lib/nequip/nn 2026-03-05T01:07:28,776 copying nequip/nn/model_modifier_utils.py -> build/lib/nequip/nn 2026-03-05T01:07:28,778 copying nequip/nn/convnetlayer.py -> build/lib/nequip/nn 2026-03-05T01:07:28,780 copying nequip/nn/mlp.py -> build/lib/nequip/nn 2026-03-05T01:07:28,782 copying nequip/nn/norm.py -> build/lib/nequip/nn 2026-03-05T01:07:28,784 copying nequip/nn/_graph_mixin.py -> build/lib/nequip/nn 2026-03-05T01:07:28,786 copying nequip/nn/_tp_scatter_cueq.py -> build/lib/nequip/nn 2026-03-05T01:07:28,788 copying nequip/nn/interaction_block.py -> build/lib/nequip/nn 2026-03-05T01:07:28,790 copying nequip/nn/utils.py -> build/lib/nequip/nn 2026-03-05T01:07:28,792 copying nequip/nn/__init__.py -> build/lib/nequip/nn 2026-03-05T01:07:28,794 copying nequip/nn/misc.py -> build/lib/nequip/nn 2026-03-05T01:07:28,796 copying nequip/nn/atomwise.py -> build/lib/nequip/nn 2026-03-05T01:07:28,799 copying nequip/nn/_tp_scatter_oeq.py -> build/lib/nequip/nn 2026-03-05T01:07:28,800 copying nequip/nn/_tp_scatter_base.py -> build/lib/nequip/nn 2026-03-05T01:07:28,803 copying nequip/nn/graph_model.py -> build/lib/nequip/nn 2026-03-05T01:07:28,805 copying nequip/nn/pair_potential.py -> build/lib/nequip/nn 2026-03-05T01:07:28,807 copying nequip/nn/_ghost_exchange_base.py -> build/lib/nequip/nn 2026-03-05T01:07:28,809 copying nequip/nn/_ghost_exchange_lmp_mliap.py -> build/lib/nequip/nn 2026-03-05T01:07:28,811 copying nequip/nn/grad_output.py -> build/lib/nequip/nn 2026-03-05T01:07:28,814 creating build/lib/nequip/train 2026-03-05T01:07:28,815 copying nequip/train/metrics.py -> build/lib/nequip/train 2026-03-05T01:07:28,817 copying nequip/train/schedulefree.py -> build/lib/nequip/train 2026-03-05T01:07:28,819 copying nequip/train/simple_ddp.py -> build/lib/nequip/train 2026-03-05T01:07:28,821 copying nequip/train/lightning.py -> build/lib/nequip/train 2026-03-05T01:07:28,823 copying nequip/train/__init__.py -> build/lib/nequip/train 2026-03-05T01:07:28,825 copying nequip/train/ema.py -> build/lib/nequip/train 2026-03-05T01:07:28,828 copying nequip/train/config.py -> build/lib/nequip/train 2026-03-05T01:07:28,830 copying nequip/train/metrics_manager.py -> build/lib/nequip/train 2026-03-05T01:07:28,833 creating build/lib/nequip/integrations 2026-03-05T01:07:28,834 copying nequip/integrations/ase.py -> build/lib/nequip/integrations 2026-03-05T01:07:28,837 copying nequip/integrations/torchsim.py -> build/lib/nequip/integrations 2026-03-05T01:07:28,839 copying nequip/integrations/mixins.py -> build/lib/nequip/integrations 2026-03-05T01:07:28,841 copying nequip/integrations/utils.py -> build/lib/nequip/integrations 2026-03-05T01:07:28,843 copying nequip/integrations/__init__.py -> build/lib/nequip/integrations 2026-03-05T01:07:28,846 creating build/lib/nequip/model/inference_models 2026-03-05T01:07:28,846 copying nequip/model/inference_models/aotinductor.py -> build/lib/nequip/model/inference_models 2026-03-05T01:07:28,849 copying nequip/model/inference_models/compiled.py -> build/lib/nequip/model/inference_models 2026-03-05T01:07:28,850 copying nequip/model/inference_models/__init__.py -> build/lib/nequip/model/inference_models 2026-03-05T01:07:28,852 copying nequip/model/inference_models/torchscript.py -> build/lib/nequip/model/inference_models 2026-03-05T01:07:28,854 creating build/lib/nequip/model/saved_models 2026-03-05T01:07:28,855 copying nequip/model/saved_models/load_utils.py -> build/lib/nequip/model/saved_models 2026-03-05T01:07:28,857 copying nequip/model/saved_models/package.py -> build/lib/nequip/model/saved_models 2026-03-05T01:07:28,859 copying nequip/model/saved_models/__init__.py -> build/lib/nequip/model/saved_models 2026-03-05T01:07:28,861 copying nequip/model/saved_models/checkpoint.py -> build/lib/nequip/model/saved_models 2026-03-05T01:07:28,863 copying nequip/model/saved_models/_utils.py -> build/lib/nequip/model/saved_models 2026-03-05T01:07:28,865 creating build/lib/nequip/utils/unittests 2026-03-05T01:07:28,866 copying nequip/utils/unittests/model_tests_basic.py -> build/lib/nequip/utils/unittests 2026-03-05T01:07:28,869 copying nequip/utils/unittests/utils.py -> build/lib/nequip/utils/unittests 2026-03-05T01:07:28,871 copying nequip/utils/unittests/model_tests.py -> build/lib/nequip/utils/unittests 2026-03-05T01:07:28,873 copying nequip/utils/unittests/model_tests_train_time_compile.py -> build/lib/nequip/utils/unittests 2026-03-05T01:07:28,875 copying nequip/utils/unittests/__init__.py -> build/lib/nequip/utils/unittests 2026-03-05T01:07:28,877 copying nequip/utils/unittests/model_tests_torchsim.py -> build/lib/nequip/utils/unittests 2026-03-05T01:07:28,879 copying nequip/utils/unittests/model_tests_ase_integration.py -> build/lib/nequip/utils/unittests 2026-03-05T01:07:28,882 copying nequip/utils/unittests/conftest.py -> build/lib/nequip/utils/unittests 2026-03-05T01:07:28,884 copying nequip/utils/unittests/model_tests_lammps.py -> build/lib/nequip/utils/unittests 2026-03-05T01:07:28,887 creating build/lib/nequip/utils/versions 2026-03-05T01:07:28,888 copying nequip/utils/versions/version_utils.py -> build/lib/nequip/utils/versions 2026-03-05T01:07:28,890 copying nequip/utils/versions/__init__.py -> build/lib/nequip/utils/versions 2026-03-05T01:07:28,891 copying nequip/utils/versions/torch_versions.py -> build/lib/nequip/utils/versions 2026-03-05T01:07:28,893 copying nequip/utils/versions/package_versions.py -> build/lib/nequip/utils/versions 2026-03-05T01:07:28,896 creating build/lib/nequip/data/datamodule 2026-03-05T01:07:28,897 copying nequip/data/datamodule/coll_datamodule.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,899 copying nequip/data/datamodule/md22_datamodule.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,901 copying nequip/data/datamodule/sgdml_datamodule.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,903 copying nequip/data/datamodule/_3bpa_datamodule.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,906 copying nequip/data/datamodule/_ase_datamodule.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,908 copying nequip/data/datamodule/__init__.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,910 copying nequip/data/datamodule/water_datamodule.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,912 copying nequip/data/datamodule/_base_datamodule.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,914 copying nequip/data/datamodule/tm23_datamodule.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,916 copying nequip/data/datamodule/rmd17_datamodule.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,918 copying nequip/data/datamodule/samd23_datamodule.py -> build/lib/nequip/data/datamodule 2026-03-05T01:07:28,921 creating build/lib/nequip/data/transforms 2026-03-05T01:07:28,922 copying nequip/data/transforms/type_mapper.py -> build/lib/nequip/data/transforms 2026-03-05T01:07:28,925 copying nequip/data/transforms/stress_utils.py -> build/lib/nequip/data/transforms 2026-03-05T01:07:28,926 copying nequip/data/transforms/__init__.py -> build/lib/nequip/data/transforms 2026-03-05T01:07:28,928 copying nequip/data/transforms/neighborlist.py -> build/lib/nequip/data/transforms 2026-03-05T01:07:28,930 copying nequip/data/transforms/cell_utils.py -> build/lib/nequip/data/transforms 2026-03-05T01:07:28,933 creating build/lib/nequip/data/dataset 2026-03-05T01:07:28,934 copying nequip/data/dataset/utils.py -> build/lib/nequip/data/dataset 2026-03-05T01:07:28,935 copying nequip/data/dataset/test_data.py -> build/lib/nequip/data/dataset 2026-03-05T01:07:28,937 copying nequip/data/dataset/hdf5_dataset.py -> build/lib/nequip/data/dataset 2026-03-05T01:07:28,939 copying nequip/data/dataset/__init__.py -> build/lib/nequip/data/dataset 2026-03-05T01:07:28,941 copying nequip/data/dataset/lmdb_dataset.py -> build/lib/nequip/data/dataset 2026-03-05T01:07:28,943 copying nequip/data/dataset/npz_dataset.py -> build/lib/nequip/data/dataset 2026-03-05T01:07:28,945 copying nequip/data/dataset/base_datasets.py -> build/lib/nequip/data/dataset 2026-03-05T01:07:28,946 copying nequip/data/dataset/ase_dataset.py -> build/lib/nequip/data/dataset 2026-03-05T01:07:28,949 creating build/lib/nequip/nn/embedding 2026-03-05T01:07:28,950 copying nequip/nn/embedding/_edge.py -> build/lib/nequip/nn/embedding 2026-03-05T01:07:28,952 copying nequip/nn/embedding/node.py -> build/lib/nequip/nn/embedding 2026-03-05T01:07:28,954 copying nequip/nn/embedding/cutoffs.py -> build/lib/nequip/nn/embedding 2026-03-05T01:07:28,956 copying nequip/nn/embedding/utils.py -> build/lib/nequip/nn/embedding 2026-03-05T01:07:28,958 copying nequip/nn/embedding/__init__.py -> build/lib/nequip/nn/embedding 2026-03-05T01:07:28,960 creating build/lib/nequip/train/callbacks 2026-03-05T01:07:28,961 copying nequip/train/callbacks/softadapt.py -> build/lib/nequip/train/callbacks 2026-03-05T01:07:28,964 copying nequip/train/callbacks/wandb_watch.py -> build/lib/nequip/train/callbacks 2026-03-05T01:07:28,965 copying nequip/train/callbacks/write_xyz.py -> build/lib/nequip/train/callbacks 2026-03-05T01:07:28,967 copying nequip/train/callbacks/__init__.py -> build/lib/nequip/train/callbacks 2026-03-05T01:07:28,969 copying nequip/train/callbacks/loss_coeff_monitor.py -> build/lib/nequip/train/callbacks 2026-03-05T01:07:28,971 copying nequip/train/callbacks/loss_coeff_scheduler.py -> build/lib/nequip/train/callbacks 2026-03-05T01:07:28,973 copying nequip/train/callbacks/tf32_scheduler.py -> build/lib/nequip/train/callbacks 2026-03-05T01:07:28,975 copying nequip/train/callbacks/training_stats.py -> build/lib/nequip/train/callbacks 2026-03-05T01:07:28,978 creating build/lib/nequip/integrations/lammps_mliap 2026-03-05T01:07:28,979 copying nequip/integrations/lammps_mliap/lmp_mliap_wrapper.py -> build/lib/nequip/integrations/lammps_mliap 2026-03-05T01:07:28,981 copying nequip/integrations/lammps_mliap/create_lmp_mliap_file.py -> build/lib/nequip/integrations/lammps_mliap 2026-03-05T01:07:28,983 running egg_info 2026-03-05T01:07:28,993 writing nequip.egg-info/PKG-INFO 2026-03-05T01:07:28,996 writing dependency_links to nequip.egg-info/dependency_links.txt 2026-03-05T01:07:28,997 writing entry points to nequip.egg-info/entry_points.txt 2026-03-05T01:07:28,999 writing requirements to nequip.egg-info/requires.txt 2026-03-05T01:07:29,000 writing top-level names to nequip.egg-info/top_level.txt 2026-03-05T01:07:29,028 reading manifest file 'nequip.egg-info/SOURCES.txt' 2026-03-05T01:07:29,037 adding license file 'LICENSE' 2026-03-05T01:07:29,037 adding license file 'AUTHORS.md' 2026-03-05T01:07:29,045 writing manifest file 'nequip.egg-info/SOURCES.txt' 2026-03-05T01:07:29,058 copying nequip/utils/unittests/minimal_aspirin.yaml -> build/lib/nequip/utils/unittests 2026-03-05T01:07:29,060 copying nequip/utils/unittests/minimal_toy_emt.yaml -> build/lib/nequip/utils/unittests 2026-03-05T01:07:29,062 creating build/lib/nequip/data/dataset_stats 2026-03-05T01:07:29,063 copying nequip/data/dataset_stats/MPTrj.yaml -> build/lib/nequip/data/dataset_stats 2026-03-05T01:07:29,066 copying nequip/data/dataset_stats/MatPES.yaml -> build/lib/nequip/data/dataset_stats 2026-03-05T01:07:29,068 copying nequip/data/dataset_stats/OMat.yaml -> build/lib/nequip/data/dataset_stats 2026-03-05T01:07:29,089 installing to build/bdist.linux-armv7l/wheel 2026-03-05T01:07:29,090 running install 2026-03-05T01:07:29,112 running install_lib 2026-03-05T01:07:29,118 creating build/bdist.linux-armv7l/wheel 2026-03-05T01:07:29,120 creating build/bdist.linux-armv7l/wheel/nequip 2026-03-05T01:07:29,121 creating build/bdist.linux-armv7l/wheel/nequip/model 2026-03-05T01:07:29,123 creating build/bdist.linux-armv7l/wheel/nequip/model/inference_models 2026-03-05T01:07:29,124 copying build/lib/nequip/model/inference_models/aotinductor.py -> build/bdist.linux-armv7l/wheel/./nequip/model/inference_models 2026-03-05T01:07:29,127 copying build/lib/nequip/model/inference_models/compiled.py -> build/bdist.linux-armv7l/wheel/./nequip/model/inference_models 2026-03-05T01:07:29,128 copying build/lib/nequip/model/inference_models/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/model/inference_models 2026-03-05T01:07:29,130 copying build/lib/nequip/model/inference_models/torchscript.py -> build/bdist.linux-armv7l/wheel/./nequip/model/inference_models 2026-03-05T01:07:29,132 copying build/lib/nequip/model/utils.py -> build/bdist.linux-armv7l/wheel/./nequip/model 2026-03-05T01:07:29,135 creating build/bdist.linux-armv7l/wheel/nequip/model/saved_models 2026-03-05T01:07:29,136 copying build/lib/nequip/model/saved_models/load_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/model/saved_models 2026-03-05T01:07:29,138 copying build/lib/nequip/model/saved_models/package.py -> build/bdist.linux-armv7l/wheel/./nequip/model/saved_models 2026-03-05T01:07:29,141 copying build/lib/nequip/model/saved_models/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/model/saved_models 2026-03-05T01:07:29,143 copying build/lib/nequip/model/saved_models/checkpoint.py -> build/bdist.linux-armv7l/wheel/./nequip/model/saved_models 2026-03-05T01:07:29,145 copying build/lib/nequip/model/saved_models/_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/model/saved_models 2026-03-05T01:07:29,147 copying build/lib/nequip/model/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/model 2026-03-05T01:07:29,149 copying build/lib/nequip/model/pair_potential.py -> build/bdist.linux-armv7l/wheel/./nequip/model 2026-03-05T01:07:29,152 copying build/lib/nequip/model/modify_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/model 2026-03-05T01:07:29,155 copying build/lib/nequip/model/nequip_models.py -> build/bdist.linux-armv7l/wheel/./nequip/model 2026-03-05T01:07:29,159 creating build/bdist.linux-armv7l/wheel/nequip/utils 2026-03-05T01:07:29,161 creating build/bdist.linux-armv7l/wheel/nequip/utils/unittests 2026-03-05T01:07:29,163 copying build/lib/nequip/utils/unittests/model_tests_basic.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,167 copying build/lib/nequip/utils/unittests/utils.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,170 copying build/lib/nequip/utils/unittests/model_tests.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,172 copying build/lib/nequip/utils/unittests/model_tests_train_time_compile.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,175 copying build/lib/nequip/utils/unittests/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,177 copying build/lib/nequip/utils/unittests/model_tests_torchsim.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,180 copying build/lib/nequip/utils/unittests/model_tests_ase_integration.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,183 copying build/lib/nequip/utils/unittests/minimal_aspirin.yaml -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,185 copying build/lib/nequip/utils/unittests/conftest.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,187 copying build/lib/nequip/utils/unittests/minimal_toy_emt.yaml -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,190 copying build/lib/nequip/utils/unittests/model_tests_lammps.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/unittests 2026-03-05T01:07:29,192 copying build/lib/nequip/utils/compile.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,194 copying build/lib/nequip/utils/modules.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,196 copying build/lib/nequip/utils/fx.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,199 copying build/lib/nequip/utils/resolvers.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,202 copying build/lib/nequip/utils/global_state.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,205 copying build/lib/nequip/utils/aoti_metadata.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,207 copying build/lib/nequip/utils/dtype.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,210 copying build/lib/nequip/utils/model_repository.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,212 copying build/lib/nequip/utils/aot.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,215 copying build/lib/nequip/utils/logger.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,217 copying build/lib/nequip/utils/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,219 copying build/lib/nequip/utils/test.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,222 copying build/lib/nequip/utils/model_cache.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,225 copying build/lib/nequip/utils/file_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,228 creating build/bdist.linux-armv7l/wheel/nequip/utils/versions 2026-03-05T01:07:29,229 copying build/lib/nequip/utils/versions/version_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/versions 2026-03-05T01:07:29,231 copying build/lib/nequip/utils/versions/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/versions 2026-03-05T01:07:29,233 copying build/lib/nequip/utils/versions/torch_versions.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/versions 2026-03-05T01:07:29,236 copying build/lib/nequip/utils/versions/package_versions.py -> build/bdist.linux-armv7l/wheel/./nequip/utils/versions 2026-03-05T01:07:29,238 copying build/lib/nequip/utils/global_dtype.py -> build/bdist.linux-armv7l/wheel/./nequip/utils 2026-03-05T01:07:29,240 creating build/bdist.linux-armv7l/wheel/nequip/data 2026-03-05T01:07:29,241 copying build/lib/nequip/data/AtomicDataDict.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,244 copying build/lib/nequip/data/_keys.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,246 copying build/lib/nequip/data/_key_registry.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,248 copying build/lib/nequip/data/ase.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,252 creating build/bdist.linux-armv7l/wheel/nequip/data/datamodule 2026-03-05T01:07:29,253 copying build/lib/nequip/data/datamodule/coll_datamodule.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,255 copying build/lib/nequip/data/datamodule/md22_datamodule.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,257 copying build/lib/nequip/data/datamodule/sgdml_datamodule.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,260 copying build/lib/nequip/data/datamodule/_3bpa_datamodule.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,262 copying build/lib/nequip/data/datamodule/_ase_datamodule.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,264 copying build/lib/nequip/data/datamodule/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,266 copying build/lib/nequip/data/datamodule/water_datamodule.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,268 copying build/lib/nequip/data/datamodule/_base_datamodule.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,270 copying build/lib/nequip/data/datamodule/tm23_datamodule.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,272 copying build/lib/nequip/data/datamodule/rmd17_datamodule.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,274 copying build/lib/nequip/data/datamodule/samd23_datamodule.py -> build/bdist.linux-armv7l/wheel/./nequip/data/datamodule 2026-03-05T01:07:29,277 creating build/bdist.linux-armv7l/wheel/nequip/data/transforms 2026-03-05T01:07:29,278 copying build/lib/nequip/data/transforms/type_mapper.py -> build/bdist.linux-armv7l/wheel/./nequip/data/transforms 2026-03-05T01:07:29,280 copying build/lib/nequip/data/transforms/stress_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/data/transforms 2026-03-05T01:07:29,282 copying build/lib/nequip/data/transforms/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/data/transforms 2026-03-05T01:07:29,283 copying build/lib/nequip/data/transforms/neighborlist.py -> build/bdist.linux-armv7l/wheel/./nequip/data/transforms 2026-03-05T01:07:29,285 copying build/lib/nequip/data/transforms/cell_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/data/transforms 2026-03-05T01:07:29,287 copying build/lib/nequip/data/dict.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,290 copying build/lib/nequip/data/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,291 copying build/lib/nequip/data/stats_manager.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,294 copying build/lib/nequip/data/_sampler.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,296 copying build/lib/nequip/data/misc.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,298 copying build/lib/nequip/data/stats.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,300 copying build/lib/nequip/data/modifier.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,302 creating build/bdist.linux-armv7l/wheel/nequip/data/dataset 2026-03-05T01:07:29,303 copying build/lib/nequip/data/dataset/utils.py -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset 2026-03-05T01:07:29,306 copying build/lib/nequip/data/dataset/test_data.py -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset 2026-03-05T01:07:29,310 copying build/lib/nequip/data/dataset/hdf5_dataset.py -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset 2026-03-05T01:07:29,312 copying build/lib/nequip/data/dataset/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset 2026-03-05T01:07:29,314 copying build/lib/nequip/data/dataset/lmdb_dataset.py -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset 2026-03-05T01:07:29,316 copying build/lib/nequip/data/dataset/npz_dataset.py -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset 2026-03-05T01:07:29,318 copying build/lib/nequip/data/dataset/base_datasets.py -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset 2026-03-05T01:07:29,320 copying build/lib/nequip/data/dataset/ase_dataset.py -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset 2026-03-05T01:07:29,322 copying build/lib/nequip/data/_nl.py -> build/bdist.linux-armv7l/wheel/./nequip/data 2026-03-05T01:07:29,325 creating build/bdist.linux-armv7l/wheel/nequip/data/dataset_stats 2026-03-05T01:07:29,326 copying build/lib/nequip/data/dataset_stats/OMat.yaml -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset_stats 2026-03-05T01:07:29,329 copying build/lib/nequip/data/dataset_stats/MPTrj.yaml -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset_stats 2026-03-05T01:07:29,331 copying build/lib/nequip/data/dataset_stats/MatPES.yaml -> build/bdist.linux-armv7l/wheel/./nequip/data/dataset_stats 2026-03-05T01:07:29,334 creating build/bdist.linux-armv7l/wheel/nequip/ase 2026-03-05T01:07:29,335 copying build/lib/nequip/ase/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/ase 2026-03-05T01:07:29,337 copying build/lib/nequip/ase/nequip_calculator.py -> build/bdist.linux-armv7l/wheel/./nequip/ase 2026-03-05T01:07:29,339 copying build/lib/nequip/ase/nosehoover.py -> build/bdist.linux-armv7l/wheel/./nequip/ase 2026-03-05T01:07:29,341 creating build/bdist.linux-armv7l/wheel/nequip/scripts 2026-03-05T01:07:29,342 copying build/lib/nequip/scripts/compile.py -> build/bdist.linux-armv7l/wheel/./nequip/scripts 2026-03-05T01:07:29,344 copying build/lib/nequip/scripts/_compile_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/scripts 2026-03-05T01:07:29,346 copying build/lib/nequip/scripts/package.py -> build/bdist.linux-armv7l/wheel/./nequip/scripts 2026-03-05T01:07:29,348 copying build/lib/nequip/scripts/train.py -> build/bdist.linux-armv7l/wheel/./nequip/scripts 2026-03-05T01:07:29,351 copying build/lib/nequip/scripts/_workflow_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/scripts 2026-03-05T01:07:29,352 copying build/lib/nequip/scripts/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/scripts 2026-03-05T01:07:29,354 copying build/lib/nequip/scripts/_package_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/scripts 2026-03-05T01:07:29,356 copying build/lib/nequip/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip 2026-03-05T01:07:29,358 creating build/bdist.linux-armv7l/wheel/nequip/nn 2026-03-05T01:07:29,359 copying build/lib/nequip/nn/compile.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,361 copying build/lib/nequip/nn/nonlinearities.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,363 copying build/lib/nequip/nn/model_modifier_utils.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,365 copying build/lib/nequip/nn/convnetlayer.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,367 copying build/lib/nequip/nn/mlp.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,369 copying build/lib/nequip/nn/norm.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,371 copying build/lib/nequip/nn/_graph_mixin.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,373 copying build/lib/nequip/nn/_tp_scatter_cueq.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,376 copying build/lib/nequip/nn/interaction_block.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,378 copying build/lib/nequip/nn/utils.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,380 copying build/lib/nequip/nn/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,382 copying build/lib/nequip/nn/misc.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,384 copying build/lib/nequip/nn/atomwise.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,386 copying build/lib/nequip/nn/_tp_scatter_oeq.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,388 copying build/lib/nequip/nn/_tp_scatter_base.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,391 copying build/lib/nequip/nn/graph_model.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,393 copying build/lib/nequip/nn/pair_potential.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,395 copying build/lib/nequip/nn/_ghost_exchange_base.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,397 copying build/lib/nequip/nn/_ghost_exchange_lmp_mliap.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,399 copying build/lib/nequip/nn/grad_output.py -> build/bdist.linux-armv7l/wheel/./nequip/nn 2026-03-05T01:07:29,402 creating build/bdist.linux-armv7l/wheel/nequip/nn/embedding 2026-03-05T01:07:29,402 copying build/lib/nequip/nn/embedding/_edge.py -> build/bdist.linux-armv7l/wheel/./nequip/nn/embedding 2026-03-05T01:07:29,405 copying build/lib/nequip/nn/embedding/node.py -> build/bdist.linux-armv7l/wheel/./nequip/nn/embedding 2026-03-05T01:07:29,407 copying build/lib/nequip/nn/embedding/cutoffs.py -> build/bdist.linux-armv7l/wheel/./nequip/nn/embedding 2026-03-05T01:07:29,409 copying build/lib/nequip/nn/embedding/utils.py -> build/bdist.linux-armv7l/wheel/./nequip/nn/embedding 2026-03-05T01:07:29,411 copying build/lib/nequip/nn/embedding/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/nn/embedding 2026-03-05T01:07:29,413 creating build/bdist.linux-armv7l/wheel/nequip/train 2026-03-05T01:07:29,414 copying build/lib/nequip/train/metrics.py -> build/bdist.linux-armv7l/wheel/./nequip/train 2026-03-05T01:07:29,417 copying build/lib/nequip/train/schedulefree.py -> build/bdist.linux-armv7l/wheel/./nequip/train 2026-03-05T01:07:29,419 copying build/lib/nequip/train/simple_ddp.py -> build/bdist.linux-armv7l/wheel/./nequip/train 2026-03-05T01:07:29,421 copying build/lib/nequip/train/lightning.py -> build/bdist.linux-armv7l/wheel/./nequip/train 2026-03-05T01:07:29,424 copying build/lib/nequip/train/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/train 2026-03-05T01:07:29,425 copying build/lib/nequip/train/ema.py -> build/bdist.linux-armv7l/wheel/./nequip/train 2026-03-05T01:07:29,429 copying build/lib/nequip/train/config.py -> build/bdist.linux-armv7l/wheel/./nequip/train 2026-03-05T01:07:29,432 creating build/bdist.linux-armv7l/wheel/nequip/train/callbacks 2026-03-05T01:07:29,434 copying build/lib/nequip/train/callbacks/softadapt.py -> build/bdist.linux-armv7l/wheel/./nequip/train/callbacks 2026-03-05T01:07:29,437 copying build/lib/nequip/train/callbacks/wandb_watch.py -> build/bdist.linux-armv7l/wheel/./nequip/train/callbacks 2026-03-05T01:07:29,438 copying build/lib/nequip/train/callbacks/write_xyz.py -> build/bdist.linux-armv7l/wheel/./nequip/train/callbacks 2026-03-05T01:07:29,441 copying build/lib/nequip/train/callbacks/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/train/callbacks 2026-03-05T01:07:29,442 copying build/lib/nequip/train/callbacks/loss_coeff_monitor.py -> build/bdist.linux-armv7l/wheel/./nequip/train/callbacks 2026-03-05T01:07:29,444 copying build/lib/nequip/train/callbacks/loss_coeff_scheduler.py -> build/bdist.linux-armv7l/wheel/./nequip/train/callbacks 2026-03-05T01:07:29,446 copying build/lib/nequip/train/callbacks/tf32_scheduler.py -> build/bdist.linux-armv7l/wheel/./nequip/train/callbacks 2026-03-05T01:07:29,448 copying build/lib/nequip/train/callbacks/training_stats.py -> build/bdist.linux-armv7l/wheel/./nequip/train/callbacks 2026-03-05T01:07:29,450 copying build/lib/nequip/train/metrics_manager.py -> build/bdist.linux-armv7l/wheel/./nequip/train 2026-03-05T01:07:29,454 copying build/lib/nequip/_version.py -> build/bdist.linux-armv7l/wheel/./nequip 2026-03-05T01:07:29,456 creating build/bdist.linux-armv7l/wheel/nequip/integrations 2026-03-05T01:07:29,457 copying build/lib/nequip/integrations/ase.py -> build/bdist.linux-armv7l/wheel/./nequip/integrations 2026-03-05T01:07:29,459 copying build/lib/nequip/integrations/torchsim.py -> build/bdist.linux-armv7l/wheel/./nequip/integrations 2026-03-05T01:07:29,462 copying build/lib/nequip/integrations/mixins.py -> build/bdist.linux-armv7l/wheel/./nequip/integrations 2026-03-05T01:07:29,464 copying build/lib/nequip/integrations/utils.py -> build/bdist.linux-armv7l/wheel/./nequip/integrations 2026-03-05T01:07:29,466 copying build/lib/nequip/integrations/__init__.py -> build/bdist.linux-armv7l/wheel/./nequip/integrations 2026-03-05T01:07:29,468 creating build/bdist.linux-armv7l/wheel/nequip/integrations/lammps_mliap 2026-03-05T01:07:29,469 copying build/lib/nequip/integrations/lammps_mliap/lmp_mliap_wrapper.py -> build/bdist.linux-armv7l/wheel/./nequip/integrations/lammps_mliap 2026-03-05T01:07:29,471 copying build/lib/nequip/integrations/lammps_mliap/create_lmp_mliap_file.py -> build/bdist.linux-armv7l/wheel/./nequip/integrations/lammps_mliap 2026-03-05T01:07:29,473 running install_egg_info 2026-03-05T01:07:29,478 Copying nequip.egg-info to build/bdist.linux-armv7l/wheel/./nequip-0.17.0-py3.11.egg-info 2026-03-05T01:07:29,489 running install_scripts 2026-03-05T01:07:29,503 creating build/bdist.linux-armv7l/wheel/nequip-0.17.0.dist-info/WHEEL 2026-03-05T01:07:29,505 creating '/tmp/pip-wheel-85zqevyo/.tmp-3ifh8i05/nequip-0.17.0-py3-none-any.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2026-03-05T01:07:29,507 adding 'nequip/__init__.py' 2026-03-05T01:07:29,509 adding 'nequip/_version.py' 2026-03-05T01:07:29,510 adding 'nequip/ase/__init__.py' 2026-03-05T01:07:29,512 adding 'nequip/ase/nequip_calculator.py' 2026-03-05T01:07:29,513 adding 'nequip/ase/nosehoover.py' 2026-03-05T01:07:29,516 adding 'nequip/data/AtomicDataDict.py' 2026-03-05T01:07:29,517 adding 'nequip/data/__init__.py' 2026-03-05T01:07:29,519 adding 'nequip/data/_key_registry.py' 2026-03-05T01:07:29,521 adding 'nequip/data/_keys.py' 2026-03-05T01:07:29,523 adding 'nequip/data/_nl.py' 2026-03-05T01:07:29,524 adding 'nequip/data/_sampler.py' 2026-03-05T01:07:29,526 adding 'nequip/data/ase.py' 2026-03-05T01:07:29,528 adding 'nequip/data/dict.py' 2026-03-05T01:07:29,529 adding 'nequip/data/misc.py' 2026-03-05T01:07:29,531 adding 'nequip/data/modifier.py' 2026-03-05T01:07:29,532 adding 'nequip/data/stats.py' 2026-03-05T01:07:29,534 adding 'nequip/data/stats_manager.py' 2026-03-05T01:07:29,536 adding 'nequip/data/datamodule/_3bpa_datamodule.py' 2026-03-05T01:07:29,538 adding 'nequip/data/datamodule/__init__.py' 2026-03-05T01:07:29,539 adding 'nequip/data/datamodule/_ase_datamodule.py' 2026-03-05T01:07:29,541 adding 'nequip/data/datamodule/_base_datamodule.py' 2026-03-05T01:07:29,543 adding 'nequip/data/datamodule/coll_datamodule.py' 2026-03-05T01:07:29,544 adding 'nequip/data/datamodule/md22_datamodule.py' 2026-03-05T01:07:29,546 adding 'nequip/data/datamodule/rmd17_datamodule.py' 2026-03-05T01:07:29,548 adding 'nequip/data/datamodule/samd23_datamodule.py' 2026-03-05T01:07:29,549 adding 'nequip/data/datamodule/sgdml_datamodule.py' 2026-03-05T01:07:29,550 adding 'nequip/data/datamodule/tm23_datamodule.py' 2026-03-05T01:07:29,552 adding 'nequip/data/datamodule/water_datamodule.py' 2026-03-05T01:07:29,554 adding 'nequip/data/dataset/__init__.py' 2026-03-05T01:07:29,555 adding 'nequip/data/dataset/ase_dataset.py' 2026-03-05T01:07:29,556 adding 'nequip/data/dataset/base_datasets.py' 2026-03-05T01:07:29,558 adding 'nequip/data/dataset/hdf5_dataset.py' 2026-03-05T01:07:29,560 adding 'nequip/data/dataset/lmdb_dataset.py' 2026-03-05T01:07:29,561 adding 'nequip/data/dataset/npz_dataset.py' 2026-03-05T01:07:29,563 adding 'nequip/data/dataset/test_data.py' 2026-03-05T01:07:29,564 adding 'nequip/data/dataset/utils.py' 2026-03-05T01:07:29,567 adding 'nequip/data/dataset_stats/MPTrj.yaml' 2026-03-05T01:07:29,570 adding 'nequip/data/dataset_stats/MatPES.yaml' 2026-03-05T01:07:29,573 adding 'nequip/data/dataset_stats/OMat.yaml' 2026-03-05T01:07:29,575 adding 'nequip/data/transforms/__init__.py' 2026-03-05T01:07:29,576 adding 'nequip/data/transforms/cell_utils.py' 2026-03-05T01:07:29,578 adding 'nequip/data/transforms/neighborlist.py' 2026-03-05T01:07:29,579 adding 'nequip/data/transforms/stress_utils.py' 2026-03-05T01:07:29,581 adding 'nequip/data/transforms/type_mapper.py' 2026-03-05T01:07:29,582 adding 'nequip/integrations/__init__.py' 2026-03-05T01:07:29,584 adding 'nequip/integrations/ase.py' 2026-03-05T01:07:29,586 adding 'nequip/integrations/mixins.py' 2026-03-05T01:07:29,587 adding 'nequip/integrations/torchsim.py' 2026-03-05T01:07:29,589 adding 'nequip/integrations/utils.py' 2026-03-05T01:07:29,591 adding 'nequip/integrations/lammps_mliap/create_lmp_mliap_file.py' 2026-03-05T01:07:29,593 adding 'nequip/integrations/lammps_mliap/lmp_mliap_wrapper.py' 2026-03-05T01:07:29,594 adding 'nequip/model/__init__.py' 2026-03-05T01:07:29,596 adding 'nequip/model/modify_utils.py' 2026-03-05T01:07:29,598 adding 'nequip/model/nequip_models.py' 2026-03-05T01:07:29,599 adding 'nequip/model/pair_potential.py' 2026-03-05T01:07:29,601 adding 'nequip/model/utils.py' 2026-03-05T01:07:29,603 adding 'nequip/model/inference_models/__init__.py' 2026-03-05T01:07:29,604 adding 'nequip/model/inference_models/aotinductor.py' 2026-03-05T01:07:29,605 adding 'nequip/model/inference_models/compiled.py' 2026-03-05T01:07:29,607 adding 'nequip/model/inference_models/torchscript.py' 2026-03-05T01:07:29,608 adding 'nequip/model/saved_models/__init__.py' 2026-03-05T01:07:29,610 adding 'nequip/model/saved_models/_utils.py' 2026-03-05T01:07:29,611 adding 'nequip/model/saved_models/checkpoint.py' 2026-03-05T01:07:29,613 adding 'nequip/model/saved_models/load_utils.py' 2026-03-05T01:07:29,615 adding 'nequip/model/saved_models/package.py' 2026-03-05T01:07:29,616 adding 'nequip/nn/__init__.py' 2026-03-05T01:07:29,618 adding 'nequip/nn/_ghost_exchange_base.py' 2026-03-05T01:07:29,619 adding 'nequip/nn/_ghost_exchange_lmp_mliap.py' 2026-03-05T01:07:29,621 adding 'nequip/nn/_graph_mixin.py' 2026-03-05T01:07:29,622 adding 'nequip/nn/_tp_scatter_base.py' 2026-03-05T01:07:29,624 adding 'nequip/nn/_tp_scatter_cueq.py' 2026-03-05T01:07:29,625 adding 'nequip/nn/_tp_scatter_oeq.py' 2026-03-05T01:07:29,627 adding 'nequip/nn/atomwise.py' 2026-03-05T01:07:29,629 adding 'nequip/nn/compile.py' 2026-03-05T01:07:29,631 adding 'nequip/nn/convnetlayer.py' 2026-03-05T01:07:29,633 adding 'nequip/nn/grad_output.py' 2026-03-05T01:07:29,635 adding 'nequip/nn/graph_model.py' 2026-03-05T01:07:29,636 adding 'nequip/nn/interaction_block.py' 2026-03-05T01:07:29,638 adding 'nequip/nn/misc.py' 2026-03-05T01:07:29,640 adding 'nequip/nn/mlp.py' 2026-03-05T01:07:29,641 adding 'nequip/nn/model_modifier_utils.py' 2026-03-05T01:07:29,642 adding 'nequip/nn/nonlinearities.py' 2026-03-05T01:07:29,644 adding 'nequip/nn/norm.py' 2026-03-05T01:07:29,646 adding 'nequip/nn/pair_potential.py' 2026-03-05T01:07:29,647 adding 'nequip/nn/utils.py' 2026-03-05T01:07:29,649 adding 'nequip/nn/embedding/__init__.py' 2026-03-05T01:07:29,651 adding 'nequip/nn/embedding/_edge.py' 2026-03-05T01:07:29,652 adding 'nequip/nn/embedding/cutoffs.py' 2026-03-05T01:07:29,654 adding 'nequip/nn/embedding/node.py' 2026-03-05T01:07:29,655 adding 'nequip/nn/embedding/utils.py' 2026-03-05T01:07:29,657 adding 'nequip/scripts/__init__.py' 2026-03-05T01:07:29,658 adding 'nequip/scripts/_compile_utils.py' 2026-03-05T01:07:29,660 adding 'nequip/scripts/_package_utils.py' 2026-03-05T01:07:29,661 adding 'nequip/scripts/_workflow_utils.py' 2026-03-05T01:07:29,663 adding 'nequip/scripts/compile.py' 2026-03-05T01:07:29,665 adding 'nequip/scripts/package.py' 2026-03-05T01:07:29,667 adding 'nequip/scripts/train.py' 2026-03-05T01:07:29,669 adding 'nequip/train/__init__.py' 2026-03-05T01:07:29,671 adding 'nequip/train/config.py' 2026-03-05T01:07:29,673 adding 'nequip/train/ema.py' 2026-03-05T01:07:29,676 adding 'nequip/train/lightning.py' 2026-03-05T01:07:29,677 adding 'nequip/train/metrics.py' 2026-03-05T01:07:29,681 adding 'nequip/train/metrics_manager.py' 2026-03-05T01:07:29,683 adding 'nequip/train/schedulefree.py' 2026-03-05T01:07:29,684 adding 'nequip/train/simple_ddp.py' 2026-03-05T01:07:29,686 adding 'nequip/train/callbacks/__init__.py' 2026-03-05T01:07:29,687 adding 'nequip/train/callbacks/loss_coeff_monitor.py' 2026-03-05T01:07:29,689 adding 'nequip/train/callbacks/loss_coeff_scheduler.py' 2026-03-05T01:07:29,691 adding 'nequip/train/callbacks/softadapt.py' 2026-03-05T01:07:29,692 adding 'nequip/train/callbacks/tf32_scheduler.py' 2026-03-05T01:07:29,694 adding 'nequip/train/callbacks/training_stats.py' 2026-03-05T01:07:29,695 adding 'nequip/train/callbacks/wandb_watch.py' 2026-03-05T01:07:29,696 adding 'nequip/train/callbacks/write_xyz.py' 2026-03-05T01:07:29,698 adding 'nequip/utils/__init__.py' 2026-03-05T01:07:29,699 adding 'nequip/utils/aot.py' 2026-03-05T01:07:29,700 adding 'nequip/utils/aoti_metadata.py' 2026-03-05T01:07:29,701 adding 'nequip/utils/compile.py' 2026-03-05T01:07:29,703 adding 'nequip/utils/dtype.py' 2026-03-05T01:07:29,704 adding 'nequip/utils/file_utils.py' 2026-03-05T01:07:29,706 adding 'nequip/utils/fx.py' 2026-03-05T01:07:29,707 adding 'nequip/utils/global_dtype.py' 2026-03-05T01:07:29,708 adding 'nequip/utils/global_state.py' 2026-03-05T01:07:29,710 adding 'nequip/utils/logger.py' 2026-03-05T01:07:29,711 adding 'nequip/utils/model_cache.py' 2026-03-05T01:07:29,713 adding 'nequip/utils/model_repository.py' 2026-03-05T01:07:29,714 adding 'nequip/utils/modules.py' 2026-03-05T01:07:29,715 adding 'nequip/utils/resolvers.py' 2026-03-05T01:07:29,718 adding 'nequip/utils/test.py' 2026-03-05T01:07:29,720 adding 'nequip/utils/unittests/__init__.py' 2026-03-05T01:07:29,721 adding 'nequip/utils/unittests/conftest.py' 2026-03-05T01:07:29,722 adding 'nequip/utils/unittests/minimal_aspirin.yaml' 2026-03-05T01:07:29,724 adding 'nequip/utils/unittests/minimal_toy_emt.yaml' 2026-03-05T01:07:29,725 adding 'nequip/utils/unittests/model_tests.py' 2026-03-05T01:07:29,726 adding 'nequip/utils/unittests/model_tests_ase_integration.py' 2026-03-05T01:07:29,731 adding 'nequip/utils/unittests/model_tests_basic.py' 2026-03-05T01:07:29,733 adding 'nequip/utils/unittests/model_tests_lammps.py' 2026-03-05T01:07:29,736 adding 'nequip/utils/unittests/model_tests_torchsim.py' 2026-03-05T01:07:29,737 adding 'nequip/utils/unittests/model_tests_train_time_compile.py' 2026-03-05T01:07:29,739 adding 'nequip/utils/unittests/utils.py' 2026-03-05T01:07:29,741 adding 'nequip/utils/versions/__init__.py' 2026-03-05T01:07:29,742 adding 'nequip/utils/versions/package_versions.py' 2026-03-05T01:07:29,744 adding 'nequip/utils/versions/torch_versions.py' 2026-03-05T01:07:29,745 adding 'nequip/utils/versions/version_utils.py' 2026-03-05T01:07:29,747 adding 'nequip-0.17.0.dist-info/licenses/AUTHORS.md' 2026-03-05T01:07:29,749 adding 'nequip-0.17.0.dist-info/licenses/LICENSE' 2026-03-05T01:07:29,750 adding 'nequip-0.17.0.dist-info/METADATA' 2026-03-05T01:07:29,751 adding 'nequip-0.17.0.dist-info/WHEEL' 2026-03-05T01:07:29,752 adding 'nequip-0.17.0.dist-info/entry_points.txt' 2026-03-05T01:07:29,753 adding 'nequip-0.17.0.dist-info/top_level.txt' 2026-03-05T01:07:29,756 adding 'nequip-0.17.0.dist-info/RECORD' 2026-03-05T01:07:29,762 removing build/bdist.linux-armv7l/wheel 2026-03-05T01:07:29,899 Building wheel for nequip (pyproject.toml): finished with status 'done' 2026-03-05T01:07:29,915 Created wheel for nequip: filename=nequip-0.17.0-py3-none-any.whl size=295771 sha256=12d170a2094b4551865df7c38030da97222ee112509b39cb382ff2c8baa7aa30 2026-03-05T01:07:29,917 Stored in directory: /tmp/pip-ephem-wheel-cache-uby57pe4/wheels/e0/02/12/70160b56bcd302535e99927eb335113bcec102bbb6ee6e070b 2026-03-05T01:07:29,944 Successfully built nequip 2026-03-05T01:07:29,960 Removed build tracker: '/tmp/pip-build-tracker-zw6keqef'