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RohanV01/Molecule_format_converter

By RohanV01

This jupyter notebook let's you convert sdf to pdb or SMILES to pdbqt file formats for a batch of compounds to perform cheminformatics and drug discovery projects

GitHub Jupyter Notebook Updated 15 Jan 2026

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This jupyter notebook let's you convert sdf to pdb or SMILES to pdbqt file formats for a batch of compounds to perform cheminformatics and drug discovery projects

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