#include <new_canon.h>
Definition at line 283 of file new_canon.h.
◆ AtomCompareFunctor() [1/2]
RDKit::Canon::AtomCompareFunctor::AtomCompareFunctor |
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◆ AtomCompareFunctor() [2/2]
RDKit::Canon::AtomCompareFunctor::AtomCompareFunctor |
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Canon::canon_atom * | atoms, |
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const ROMol & | m, |
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const boost::dynamic_bitset<> * | atomsInPlay = nullptr, |
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const boost::dynamic_bitset<> * | bondsInPlay = nullptr ) |
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◆ operator()()
int RDKit::Canon::AtomCompareFunctor::operator() |
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int | i, |
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int | j ) const |
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◆ df_useAtomMaps
bool RDKit::Canon::AtomCompareFunctor::df_useAtomMaps {true} |
◆ df_useChirality
bool RDKit::Canon::AtomCompareFunctor::df_useChirality {true} |
◆ df_useChiralityRings
bool RDKit::Canon::AtomCompareFunctor::df_useChiralityRings {true} |
◆ df_useChiralPresence
bool RDKit::Canon::AtomCompareFunctor::df_useChiralPresence {true} |
◆ df_useIsotopes
bool RDKit::Canon::AtomCompareFunctor::df_useIsotopes {true} |
◆ df_useNbrs
bool RDKit::Canon::AtomCompareFunctor::df_useNbrs {false} |
◆ df_useNonStereoRanks
bool RDKit::Canon::AtomCompareFunctor::df_useNonStereoRanks {false} |
◆ dp_atoms
◆ dp_atomsInPlay
const boost::dynamic_bitset* RDKit::Canon::AtomCompareFunctor::dp_atomsInPlay {nullptr} |
◆ dp_bondsInPlay
const boost::dynamic_bitset * RDKit::Canon::AtomCompareFunctor::dp_bondsInPlay {nullptr} |
◆ dp_mol
const ROMol* RDKit::Canon::AtomCompareFunctor::dp_mol {nullptr} |
The documentation for this class was generated from the following file: