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  1. Hazard-Classifier Hazard-Classifier Public

    Calculator for GHS-compliant estimation of health hazards of mixtures

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  2. CatSperML CatSperML Public

    Public code for the Explainable pharmacophore model developed and used in the discovery of CatSper Inhibitors

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  3. Orca_workflow Orca_workflow Public

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  4. xyz2mol_ligand xyz2mol_ligand Public

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    xyz2mol for transition metal complexes

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