CDPL::GRAIL::FeatureType Namespace Reference

Provides constants for the specification of pharmacophore feature types with extensions for H-bond acceptors and donors. More...

Variables
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

Detailed Description

Provides constants for the specification of pharmacophore feature types with extensions for H-bond acceptors and donors.

Variable Documentation

H_BOND_DONOR_N

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_N = MAX_TYPE + 1

H_BOND_DONOR_N3

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_N3 = MAX_TYPE + 2

H_BOND_DONOR_N2

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_N2 = MAX_TYPE + 3

H_BOND_DONOR_Nar

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_Nar = MAX_TYPE + 4

H_BOND_DONOR_Nam

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_Nam = MAX_TYPE + 5

H_BOND_DONOR_Npl3

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_Npl3 = MAX_TYPE + 6

H_BOND_DONOR_N4

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_N4 = MAX_TYPE + 7

H_BOND_DONOR_O

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_O = MAX_TYPE + 8

H_BOND_DONOR_O3

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_O3 = MAX_TYPE + 9

H_BOND_DONOR_S

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_S = MAX_TYPE + 10

H_BOND_DONOR_S3

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_DONOR_S3 = MAX_TYPE + 11

H_BOND_ACCEPTOR_N

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_N = MAX_TYPE + 12

H_BOND_ACCEPTOR_N3

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_N3 = MAX_TYPE + 13

H_BOND_ACCEPTOR_N2

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_N2 = MAX_TYPE + 14

H_BOND_ACCEPTOR_N1

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_N1 = MAX_TYPE + 15

H_BOND_ACCEPTOR_Nar

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_Nar = MAX_TYPE + 16

H_BOND_ACCEPTOR_Npl3

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_Npl3 = MAX_TYPE + 17

H_BOND_ACCEPTOR_O

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_O = MAX_TYPE + 18

H_BOND_ACCEPTOR_O3

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_O3 = MAX_TYPE + 19

H_BOND_ACCEPTOR_O2

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_O2 = MAX_TYPE + 20

H_BOND_ACCEPTOR_Oco2

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_Oco2 = MAX_TYPE + 21

H_BOND_ACCEPTOR_S

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_S = MAX_TYPE + 22

H_BOND_ACCEPTOR_S3

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_S3 = MAX_TYPE + 23

H_BOND_ACCEPTOR_S2

const unsigned int CDPL::GRAIL::FeatureType::H_BOND_ACCEPTOR_S2 = MAX_TYPE + 24

MAX_EXT_TYPE

const unsigned int CDPL::GRAIL::FeatureType::MAX_EXT_TYPE = H_BOND_ACCEPTOR_S2