Chemical Data Processing Library C++ API - Version 1.1.1
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Provides constants used to specify the structural class of H-bond acceptor atoms. More...
Variables | |
const unsigned int | UNDEF = 0 |
Specifies that the H-bond acceptor type of the atom is undefined. More... | |
const unsigned int | NONE = 1 |
Specifies that the atom is not a H-bond acceptor. More... | |
const unsigned int | O_H2O = 2 |
const unsigned int | O_UREA = 3 |
const unsigned int | O_BARBITURIC_ACID = 4 |
const unsigned int | O_URIC_ACID = 5 |
const unsigned int | O_ETHER = 6 |
const unsigned int | O_AMIDE = 7 |
const unsigned int | O_N_OXIDE = 8 |
const unsigned int | O_ACID = 9 |
const unsigned int | O_ESTER = 10 |
const unsigned int | O_SULFOXIDE = 11 |
const unsigned int | O_NITRO = 12 |
const unsigned int | O_SELEN_OXIDE = 13 |
const unsigned int | O_ALDEHYD = 14 |
const unsigned int | O_KETONE = 15 |
const unsigned int | O_ALCOHOL = 16 |
const unsigned int | N_NH3 = 17 |
const unsigned int | N_DIAMINE = 18 |
const unsigned int | N_MONO_DI_NITRO_ANILINE = 19 |
const unsigned int | N_TRI_NITRO_ANILINE = 20 |
const unsigned int | N_HALOGENO_ANILINE = 21 |
const unsigned int | N_ANILINE = 22 |
const unsigned int | N_NITRILE = 23 |
const unsigned int | N_AZOLE = 24 |
const unsigned int | N_AMINE = 25 |
const unsigned int | N_AMIDINE = 26 |
const unsigned int | N_AZO = 27 |
const unsigned int | N_AZINE = 28 |
const unsigned int | N_DIAZINE = 29 |
const unsigned int | N_IMINE = 30 |
const unsigned int | S_SULFIDE = 31 |
const unsigned int | S_THIOUREA = 32 |
const unsigned int | P_MONO_DI_PHOSPHINE = 33 |
const unsigned int | P_TRI_PHOSPHINE = 34 |
const unsigned int | MAX_TYPE = P_TRI_PHOSPHINE |
Provides constants used to specify the structural class of H-bond acceptor atoms.
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::UNDEF = 0 |
Specifies that the H-bond acceptor type of the atom is undefined.
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::NONE = 1 |
Specifies that the atom is not a H-bond acceptor.
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_H2O = 2 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_UREA = 3 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_BARBITURIC_ACID = 4 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_URIC_ACID = 5 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_ETHER = 6 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_AMIDE = 7 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_N_OXIDE = 8 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_ACID = 9 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_ESTER = 10 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_SULFOXIDE = 11 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_NITRO = 12 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_SELEN_OXIDE = 13 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_ALDEHYD = 14 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_KETONE = 15 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::O_ALCOHOL = 16 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_NH3 = 17 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_DIAMINE = 18 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_MONO_DI_NITRO_ANILINE = 19 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_TRI_NITRO_ANILINE = 20 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_HALOGENO_ANILINE = 21 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_ANILINE = 22 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_NITRILE = 23 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_AZOLE = 24 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_AMINE = 25 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_AMIDINE = 26 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_AZO = 27 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_AZINE = 28 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_DIAZINE = 29 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::N_IMINE = 30 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::S_SULFIDE = 31 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::S_THIOUREA = 32 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::P_MONO_DI_PHOSPHINE = 33 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::P_TRI_PHOSPHINE = 34 |
const unsigned int CDPL::MolProp::HBondAcceptorAtomType::MAX_TYPE = P_TRI_PHOSPHINE |