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
- matplotlib >=3.5
- mdtraj >=1.9.7
- numpy >=2.0
- pandas >=1.4
- pillow >=10.0
- python-pptx >=0.6.21
- pyyaml >=6.0
- scikit-learn >=1.0
- scipy >=1.7
30 optional dependencies
-
fastmdxplora[all]extra == "all"
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markdown>=3.4[pdf]extra == "pdf"
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mdanalysis>=2.7[validation]extra == "validation"
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myst-parser>=2.0[docs]extra == "docs"
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netcdf4>=1.6[amber]extra == "amber"
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openmm>=8.2[md]extra == "md"
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openmmforcefields>=0.12[ligand]extra == "ligand"
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pdbfixer[md]extra == "md"
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prolif>=2.0[validation]extra == "validation"
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propka>=3.5[dev]extra == "dev"
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propka>=3.5[test]extra == "test"
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propka>=3.5[ligand]extra == "ligand"
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pytest>=7.0[test]extra == "test"
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pytest>=7.0[dev]extra == "dev"
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pytest-cov>=4.0[dev]extra == "dev"
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pytest-cov>=4.0[test]extra == "test"
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pytest-timeout>=2.1[test]extra == "test"
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pytest-timeout>=2.1[dev]extra == "dev"
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python-pptx>=0.6.21[dev]extra == "dev"
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rdkit>=2023.3[test]extra == "test"
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rdkit>=2023.3[ligand]extra == "ligand"
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rdkit>=2023.3[dev]extra == "dev"
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ruff>=0.5.0[dev]extra == "dev"
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ruff>=0.5.0[test]extra == "test"
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sphinx>=7.0[docs]extra == "docs"
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sphinx-rtd-theme>=2.0[docs]extra == "docs"
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tomli>=2.0[dev]python_version < "3.11" and extra == "dev"
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tomli>=2.0[test]python_version < "3.11" and extra == "test"
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umap-learn>=0.5[umap]extra == "umap"
-
weasyprint>=60[pdf]extra == "pdf"
Used By
- fastmdx 1.8K/mo