PDBe CCDUtils: an RDKit-based toolkit for handling and analysing small molecules in the Protein Data Bank - researchr publication authors

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Ibrahim Roshan Kunnakkattu, Preeti Choudhary, Lukás Pravda, Nurul Nadzirin, Oliver S. Smart, Qi Yuan, Stephen Anyango, Sreenath Nair, Mihaly Varadi, Sameer Velankar. PDBe CCDUtils: an RDKit-based toolkit for handling and analysing small molecules in the Protein Data Bank. J. Cheminformatics, 15(1):117, December 2023. [doi]

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