Chemical Data Processing Library C++ API - Version 1.1.1
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Provides constants for the specification of pharmacophore feature types with extensions for H-bond acceptors and donors. More...
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const unsigned int | H_BOND_DONOR_N = MAX_TYPE + 1 |
const unsigned int | H_BOND_DONOR_N3 = MAX_TYPE + 2 |
const unsigned int | H_BOND_DONOR_N2 = MAX_TYPE + 3 |
const unsigned int | H_BOND_DONOR_Nar = MAX_TYPE + 4 |
const unsigned int | H_BOND_DONOR_Nam = MAX_TYPE + 5 |
const unsigned int | H_BOND_DONOR_Npl3 = MAX_TYPE + 6 |
const unsigned int | H_BOND_DONOR_N4 = MAX_TYPE + 7 |
const unsigned int | H_BOND_DONOR_O = MAX_TYPE + 8 |
const unsigned int | H_BOND_DONOR_O3 = MAX_TYPE + 9 |
const unsigned int | H_BOND_DONOR_S = MAX_TYPE + 10 |
const unsigned int | H_BOND_DONOR_S3 = MAX_TYPE + 11 |
const unsigned int | H_BOND_ACCEPTOR_N = MAX_TYPE + 12 |
const unsigned int | H_BOND_ACCEPTOR_N3 = MAX_TYPE + 13 |
const unsigned int | H_BOND_ACCEPTOR_N2 = MAX_TYPE + 14 |
const unsigned int | H_BOND_ACCEPTOR_N1 = MAX_TYPE + 15 |
const unsigned int | H_BOND_ACCEPTOR_Nar = MAX_TYPE + 16 |
const unsigned int | H_BOND_ACCEPTOR_Npl3 = MAX_TYPE + 17 |
const unsigned int | H_BOND_ACCEPTOR_O = MAX_TYPE + 18 |
const unsigned int | H_BOND_ACCEPTOR_O3 = MAX_TYPE + 19 |
const unsigned int | H_BOND_ACCEPTOR_O2 = MAX_TYPE + 20 |
const unsigned int | H_BOND_ACCEPTOR_Oco2 = MAX_TYPE + 21 |
const unsigned int | H_BOND_ACCEPTOR_S = MAX_TYPE + 22 |
const unsigned int | H_BOND_ACCEPTOR_S3 = MAX_TYPE + 23 |
const unsigned int | H_BOND_ACCEPTOR_S2 = MAX_TYPE + 24 |
const unsigned int | MAX_EXT_TYPE = H_BOND_ACCEPTOR_S2 |
Provides constants for the specification of pharmacophore feature types with extensions for H-bond acceptors and donors.
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_N = MAX_TYPE + 1 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_N3 = MAX_TYPE + 2 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_N2 = MAX_TYPE + 3 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_Nar = MAX_TYPE + 4 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_Nam = MAX_TYPE + 5 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_Npl3 = MAX_TYPE + 6 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_N4 = MAX_TYPE + 7 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_O = MAX_TYPE + 8 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_O3 = MAX_TYPE + 9 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_S = MAX_TYPE + 10 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_S3 = MAX_TYPE + 11 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_N = MAX_TYPE + 12 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_N3 = MAX_TYPE + 13 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_N2 = MAX_TYPE + 14 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_N1 = MAX_TYPE + 15 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_Nar = MAX_TYPE + 16 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_Npl3 = MAX_TYPE + 17 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_O = MAX_TYPE + 18 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_O3 = MAX_TYPE + 19 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_O2 = MAX_TYPE + 20 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_Oco2 = MAX_TYPE + 21 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_S = MAX_TYPE + 22 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_S3 = MAX_TYPE + 23 |
const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_S2 = MAX_TYPE + 24 |
const unsigned int CDPL::GRAIL::FeatureType::MAX_EXT_TYPE = H_BOND_ACCEPTOR_S2 |