addAtomMappingConstraint(std::size_t atom1_idx, std::size_t atom2_idx) | CDPL::Chem::AutomorphismGroupSearch | |
addBondMappingConstraint(std::size_t bond1_idx, std::size_t bond2_idx) | CDPL::Chem::AutomorphismGroupSearch | |
AutomorphismGroupSearch(unsigned int atom_flags=DEF_ATOM_PROPERTY_FLAGS, unsigned int bond_flags=DEF_BOND_PROPERTY_FLAGS) | CDPL::Chem::AutomorphismGroupSearch | |
begin() | CDPL::Chem::AutomorphismGroupSearch | |
begin() const | CDPL::Chem::AutomorphismGroupSearch | |
clearAtomMappingConstraints() | CDPL::Chem::AutomorphismGroupSearch | |
clearBondMappingConstraints() | CDPL::Chem::AutomorphismGroupSearch | |
ConstMappingIterator typedef | CDPL::Chem::AutomorphismGroupSearch | |
DEF_ATOM_PROPERTY_FLAGS | CDPL::Chem::AutomorphismGroupSearch | static |
DEF_BOND_PROPERTY_FLAGS | CDPL::Chem::AutomorphismGroupSearch | static |
end() | CDPL::Chem::AutomorphismGroupSearch | |
end() const | CDPL::Chem::AutomorphismGroupSearch | |
findMappings(const MolecularGraph &molgraph) | CDPL::Chem::AutomorphismGroupSearch | |
getAtomPropertyFlags() const | CDPL::Chem::AutomorphismGroupSearch | |
getBondPropertyFlags() const | CDPL::Chem::AutomorphismGroupSearch | |
getFoundMappingCallback() const | CDPL::Chem::AutomorphismGroupSearch | |
getMapping(std::size_t idx) | CDPL::Chem::AutomorphismGroupSearch | |
getMapping(std::size_t idx) const | CDPL::Chem::AutomorphismGroupSearch | |
getMappingsBegin() | CDPL::Chem::AutomorphismGroupSearch | |
getMappingsBegin() const | CDPL::Chem::AutomorphismGroupSearch | |
getMappingsEnd() | CDPL::Chem::AutomorphismGroupSearch | |
getMappingsEnd() const | CDPL::Chem::AutomorphismGroupSearch | |
getMaxNumMappings() const | CDPL::Chem::AutomorphismGroupSearch | |
getNumMappings() const | CDPL::Chem::AutomorphismGroupSearch | |
identityMappingIncluded() const | CDPL::Chem::AutomorphismGroupSearch | |
includeIdentityMapping(bool include) | CDPL::Chem::AutomorphismGroupSearch | |
MappingCallbackFunction typedef | CDPL::Chem::AutomorphismGroupSearch | |
MappingIterator typedef | CDPL::Chem::AutomorphismGroupSearch | |
setAtomPropertyFlags(unsigned int flags) | CDPL::Chem::AutomorphismGroupSearch | |
setBondPropertyFlags(unsigned int flags) | CDPL::Chem::AutomorphismGroupSearch | |
setFoundMappingCallback(const MappingCallbackFunction &func) | CDPL::Chem::AutomorphismGroupSearch | |
setMaxNumMappings(std::size_t max_num_mappings) | CDPL::Chem::AutomorphismGroupSearch | |
SharedPointer typedef | CDPL::Chem::AutomorphismGroupSearch | |
stopSearch() | CDPL::Chem::AutomorphismGroupSearch | |