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