RDKit
Open-source cheminformatics and machine learning.
|
Functions | |
RDKIT_CHEMTRANSFORMS_EXPORT void | updateSubMolConfs (const ROMol &mol, RWMol &res, boost::dynamic_bitset<> &removedAtoms) |
not recommended for use in other code | |
RDKIT_CHEMTRANSFORMS_EXPORT void | copyStereoGroups (const std::map< const Atom *, Atom * > &molAtomMap, const ROMol &mol, RWMol &newMol) |
RDKIT_CHEMTRANSFORMS_EXPORT void RDKit::details::copyStereoGroups | ( | const std::map< const Atom *, Atom * > & | molAtomMap, |
const ROMol & | mol, | ||
RWMol & | newMol | ||
) |
RDKIT_CHEMTRANSFORMS_EXPORT void RDKit::details::updateSubMolConfs | ( | const ROMol & | mol, |
RWMol & | res, | ||
boost::dynamic_bitset<> & | removedAtoms | ||
) |
not recommended for use in other code