Downloads in the 30 and 7 days to October 10, 2026. Refreshed weekly.
Package Information
No reported malware or high/critical advisories · Details
The current version has no OSV.dev malware reports and no critical or high-severity vulnerabilities.
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Dependencies
- aimnet >=0.2
- numpy >=1.21.0
- pandas >=1.3.0
- psutil >=5.8.0
- pydantic >=2.0
- pyyaml >=6.0
- rdkit >=2022.9.5
- requests >=2.32.3
- rich >=13.0.0
- send2trash >=1.8.0
- torch >=2.8
- tqdm >=4.60.0
- typer >=0.12.0
14 optional dependencies
-
ase>=3.23.0[ase]extra == "ase"
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auto3d[all]extra == "all"
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mypy>=1.0[dev]extra == "dev"
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myst-parser>=2.0[docs]extra == "docs"
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nbsphinx>=0.9.0[docs]extra == "docs"
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pre-commit>=3.0[dev]extra == "dev"
-
pytest>=7.0[dev]extra == "dev"
-
pytest-cov>=4.0[dev]extra == "dev"
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pytest-timeout>=2.3[dev]extra == "dev"
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ruff==0.15.9[dev]extra == "dev"
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sphinx>=7.0[docs]extra == "docs"
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sphinx-rtd-theme>=1.3.0[docs]extra == "docs"
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torchani>=2.8[ani]extra == "ani"
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types-requests[dev]extra == "dev"