RDKit
Open-source cheminformatics and machine learning.
RDKit::MolStandardize::TautomerEnumerator Member List

This is the complete list of members for RDKit::MolStandardize::TautomerEnumerator, including all inherited members.

canonicalize(const ROMol &mol, boost::function< int(const ROMol &mol)> scoreFunc=TautomerScoringFunctions::scoreTautomer) constRDKit::MolStandardize::TautomerEnumeratorinline
enumerate(const ROMol &mol, boost::dynamic_bitset<> *modifiedAtoms=nullptr, boost::dynamic_bitset<> *modifiedBonds=nullptr) constRDKit::MolStandardize::TautomerEnumerator
operator=(const TautomerEnumerator &other)RDKit::MolStandardize::TautomerEnumeratorinline
pickCanonical(const std::vector< ROMOL_SPTR > &tautomers, boost::function< int(const ROMol &mol)> scoreFunc=TautomerScoringFunctions::scoreTautomer) constRDKit::MolStandardize::TautomerEnumerator
TautomerEnumerator()=deleteRDKit::MolStandardize::TautomerEnumerator
TautomerEnumerator(TautomerCatalog *tautCat)RDKit::MolStandardize::TautomerEnumeratorinline
TautomerEnumerator(const TautomerEnumerator &other)RDKit::MolStandardize::TautomerEnumeratorinline