RDKit: Member List

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