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
- numpy >=1.21
- pandas !=2.0.0,>=1.3
- posebusters >=0.2
- rdkit >=2022.3
- spyrmsd >=0.6
- torch >=1.10
- tqdm >=4.60
3 optional dependencies
-
pytest>=7.0[dev]extra == "dev"
-
pytest-cov>=4.0[dev]extra == "dev"
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ruff>=0.4[dev]extra == "dev"
Used By
- hedgehog 3.2K/mo