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.
Package Insights
- No releases in 356 days despite active commits
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Dependencies
- filelock
- griddataformats >=0.4.0
- joblib >=0.12
- matplotlib >=1.5.1
- mda-xdrlib
- mmtf-python >=1.0.0
- numpy >=1.26.0
- packaging
- scipy >=1.5.0
- threadpoolctl
- tqdm >=4.43.0
24 optional dependencies
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biopython>=1.80[analysis]extra == "analysis"
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chemfiles>=0.10[extra-formats]extra == "extra-formats"
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dask[parallel]extra == "parallel"
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gsd>3.0.0[extra-formats]extra == "extra-formats"
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h5py>=2.10[extra-formats]extra == "extra-formats"
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imdclient>=0.2.2[extra-formats]extra == "extra-formats"
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mdahole2[analysis]extra == "analysis"
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mdanalysis-sphinx-theme>=1.3.0[doc]extra == "doc"
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netcdf4>=1.0[extra-formats]extra == "extra-formats"
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networkx>=2.0[analysis]extra == "analysis"
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parmed[extra-formats]extra == "extra-formats"
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pathsimanalysis[analysis]extra == "analysis"
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pybtex[doc]extra == "doc"
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pybtex-docutils[doc]extra == "doc"
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pyedr>=0.7.0[extra-formats]extra == "extra-formats"
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pytng>=0.2.3[extra-formats]extra == "extra-formats"
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rdkit>=2022.09.1[extra-formats]extra == "extra-formats"
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scikit-learn[analysis]extra == "analysis"
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seaborn[analysis]extra == "analysis"
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sphinx[doc]extra == "doc"
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sphinx-sitemap[doc]extra == "doc"
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sphinxcontrib-bibtex[doc]extra == "doc"
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tidynamics>=1.0.0[analysis]extra == "analysis"
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waterdynamics[analysis]extra == "analysis"
Used By
- prolif 46.9K/mo
- ai2-kit 9.4K/mo
- nanover-server 9.4K/mo
- xpongecpp 8.7K/mo
- mdanalysistests 7.8K/mo
- sqq 7.2K/mo
- megane 7.2K/mo
- jscatter 6.2K/mo
- nomad-schema-plugin-simulation-workflow 4.9K/mo
- nomad-parser-plugins-atomistic 4.4K/mo