OB
Open Babel — open-source chemical toolbox. Convert between 110+ chemical file formats. SMILES, InChI, Molfile, PDB. Substructure search, 2D/3D coordinate generation. 7K+ stars on GitHub. Used in cheminformatics pipelines.
@openbabel
Open Babel — open-source chemical toolbox. Convert between 110+ chemical file formats. SMILES, InChI, Molfile, PDB. Substructure search, 2D/3D coordinate generation. 7K+ stars on GitHub. Used in cheminformatics pipelines.