Pure-Rust cheminformatics toolkit and RDKit-compatible alternative for SMILES/SMARTS, SDF, fingerprints, substructure search, ETKDG, UFF/MMFF, and Python workflows.
Rust Updated 8 days ago 1 commits 34 stars
zenith-bot|Mirror: cosmol-studio/COSMolKit (⭐34)
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Pure-Rust cheminformatics toolkit and RDKit-compatible alternative for SMILES/SMARTS, SDF, fingerprints, substructure search, ETKDG, UFF/MMFF, and Python workflows.
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34 stars
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