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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::TautomerEnumerator
canonicalizeInPlace(RWMol &mol, boost::function< int(const ROMol &mol)> scoreFunc=TautomerScoringFunctions::scoreTautomer) constRDKit::MolStandardize::TautomerEnumerator
enumerate(const ROMol &mol) constRDKit::MolStandardize::TautomerEnumerator
enumerate(const ROMol &mol, boost::dynamic_bitset<> *modifiedAtoms, boost::dynamic_bitset<> *modifiedBonds=nullptr) constRDKit::MolStandardize::TautomerEnumerator
getCallback() constRDKit::MolStandardize::TautomerEnumeratorinline
getMaxTautomers()RDKit::MolStandardize::TautomerEnumeratorinline
getMaxTransforms()RDKit::MolStandardize::TautomerEnumeratorinline
getReassignStereo()RDKit::MolStandardize::TautomerEnumeratorinline
getRemoveBondStereo()RDKit::MolStandardize::TautomerEnumeratorinline
getRemoveIsotopicHs()RDKit::MolStandardize::TautomerEnumeratorinline
getRemoveSp3Stereo()RDKit::MolStandardize::TautomerEnumeratorinline
operator=(const TautomerEnumerator &other)RDKit::MolStandardize::TautomerEnumeratorinline
pickCanonical(const TautomerEnumeratorResult &tautRes, boost::function< int(const ROMol &mol)> scoreFunc=TautomerScoringFunctions::scoreTautomer) constRDKit::MolStandardize::TautomerEnumerator
pickCanonical(const Iterable &tautomers, boost::function< int(const ROMol &mol)> scoreFunc=TautomerScoringFunctions::scoreTautomer) constRDKit::MolStandardize::TautomerEnumeratorinline
setCallback(TautomerEnumeratorCallback *callback)RDKit::MolStandardize::TautomerEnumeratorinline
setMaxTautomers(unsigned int maxTautomers)RDKit::MolStandardize::TautomerEnumeratorinline
setMaxTransforms(unsigned int maxTransforms)RDKit::MolStandardize::TautomerEnumeratorinline
setReassignStereo(bool reassignStereo)RDKit::MolStandardize::TautomerEnumeratorinline
setRemoveBondStereo(bool removeBondStereo)RDKit::MolStandardize::TautomerEnumeratorinline
setRemoveIsotopicHs(bool removeIsotopicHs)RDKit::MolStandardize::TautomerEnumeratorinline
setRemoveSp3Stereo(bool removeSp3Stereo)RDKit::MolStandardize::TautomerEnumeratorinline
TautomerEnumerator(TautomerCatalog *tautCat)RDKit::MolStandardize::TautomerEnumeratorinline
TautomerEnumerator(const CleanupParameters &params=CleanupParameters())RDKit::MolStandardize::TautomerEnumerator
TautomerEnumerator(const TautomerEnumerator &other)RDKit::MolStandardize::TautomerEnumeratorinline