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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((week_daily_avg - month_daily_avg) / month_daily_avg) * 100More insights and metrics
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Dependencies
18 optional dependencies
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mdanalysis>=2.9.0[modelling]extra == "modelling"
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mdanalysis>=2.9.0[all]extra == "all"
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myst-parser>=2.0[docs]extra == "docs"
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openbabel-wheel>=3.1.1.21[modelling]extra == "modelling"
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openbabel-wheel>=3.1.1.21[all]extra == "all"
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peptides>=0.3.4[all]extra == "all"
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peptides>=0.3.4[modelling]extra == "modelling"
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prolif>=2.0.3[modelling]extra == "modelling"
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prolif>=2.0.3[all]extra == "all"
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rdkit>=2025.3.2[modelling]extra == "modelling"
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rdkit>=2025.3.2[all]extra == "all"
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scikit-learn>=1.4.0[all]extra == "all"
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sphinx>=6.0[docs]extra == "docs"
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sphinx-copybutton[docs]extra == "docs"
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sphinx-design>=0.5[docs]extra == "docs"
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sphinx-rtd-theme[docs]extra == "docs"
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sphinxcontrib-bibtex[docs]extra == "docs"
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umap-learn>=0.1.1[all]extra == "all"