HBondAcceptorAtomType.hpp File Reference

Definition of constants in namespace CDPL::MolProp::HBondAcceptorAtomType. More...

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Namespaces
	CDPL
	The namespace of the Chemical Data Processing Library.
	CDPL::MolProp
	Contains classes and functions related to the calculation/preciction of physicochemical molecular properties.
	CDPL::MolProp::HBondAcceptorAtomType
	Provides constants used to specify the structural class of H-bond acceptor atoms.

Variables
const unsigned int	CDPL::MolProp::HBondAcceptorAtomType::UNDEF = 0
	Specifies that the H-bond acceptor type of the atom is undefined. More...
const unsigned int	CDPL::MolProp::HBondAcceptorAtomType::NONE = 1
	Specifies that the atom is not a H-bond acceptor. More...
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

Detailed Description

Definition of constants in namespace CDPL::MolProp::HBondAcceptorAtomType.