WebJul 11, 2024 · did not match C++ signature: MolToSmiles (class RDKit::ROMol mol, bool isomericSmiles=True, bool kekuleSmiles=False, int rootedAtAtom=-1, bool canonical=True, bool allBondsExplicit=False, bool allHsExplicit=False, bool doRandom=False) April 8, 2024 at 4:54 pm #30812 ikk6 Keymaster Hello. Are you sure your "large" file is properly … WebJun 18, 2024 · ArgumentError: Python argument types in MolDraw2D.DrawMolecules (MolDraw2DCairo, list) did not match C++ signature: DrawMolecules (RDKit::MolDraw2D {lvalue} self, boost::python::api::object mols, boost::python::api::object highlightAtoms=None, boost::python::api::object highlightBonds=None, boost::python::api::object …
EmbedMultipleConfs Python argument types error #2536 - Github
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Error file with multiple ligands – Durrant Lab
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