HBondDonorAtomType.hpp File Reference

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

Go to the source code of this file.

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::HBondDonorAtomType
	Provides constants used to specify the structural class of H-bond donor atoms.

Variables
const unsigned int	CDPL::MolProp::HBondDonorAtomType::UNDEF = 0
	Specifies that the H-bond donor type of the atom is undefined. More...
const unsigned int	CDPL::MolProp::HBondDonorAtomType::NONE = 1
	Specifies that the atom is not a H-bond donor. More...
const unsigned int	CDPL::MolProp::HBondDonorAtomType::I_HI = 2
const unsigned int	CDPL::MolProp::HBondDonorAtomType::BR_HBR = 3
const unsigned int	CDPL::MolProp::HBondDonorAtomType::CL_HCL = 4
const unsigned int	CDPL::MolProp::HBondDonorAtomType::S_HSCN = 5
const unsigned int	CDPL::MolProp::HBondDonorAtomType::F_HF = 6
const unsigned int	CDPL::MolProp::HBondDonorAtomType::H_H2 = 7
const unsigned int	CDPL::MolProp::HBondDonorAtomType::C_HCN = 8
const unsigned int	CDPL::MolProp::HBondDonorAtomType::C_ETHINE = 9
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_HN3 = 10
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_NH3 = 11
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_NH4 = 12
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_AMINE = 13
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_AMINIUM = 14
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_ANILINE = 15
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_MONO_DI_NITRO_ANILINE = 16
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_TRI_NITRO_ANILINE = 17
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_PYRROLE = 18
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_AMIDE = 19
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_IMINE = 20
const unsigned int	CDPL::MolProp::HBondDonorAtomType::N_IMINIUM = 21
const unsigned int	CDPL::MolProp::HBondDonorAtomType::S_H2S = 22
const unsigned int	CDPL::MolProp::HBondDonorAtomType::S_HS = 23
const unsigned int	CDPL::MolProp::HBondDonorAtomType::S_THIOL = 24
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_H3PO4 = 25
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_H2CO3 = 26
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_HCO3 = 27
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_H2O2 = 28
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_H2O = 29
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_CF3SO3H = 30
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_HCLO4 = 31
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_H2SO4 = 32
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_HNO3 = 33
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_HSO4 = 34
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_HNO2 = 35
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_NH2OH = 36
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_H2PO4 = 37
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_H3BO3 = 38
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_H4SIO4 = 39
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_HPO4 = 40
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_H2BO3 = 41
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_HO = 42
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_SULFONIC_ACID = 43
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_MONO_DI_NITRO_PHENOL = 44
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_HALOGENO_ALCOHOL = 45
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_ALCOHOL = 46
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_TRI_NITRO_PHENOL = 47
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_HALOGENO_PHENOL = 48
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_PHENOL = 49
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_CARBOXYLIC_ACID = 50
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_HALOGENO_CARBOXYCLIC_ACID = 51
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_ENOL = 52
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_OXIME = 53
const unsigned int	CDPL::MolProp::HBondDonorAtomType::O_CL5_PHENOL = 54
const unsigned int	CDPL::MolProp::HBondDonorAtomType::MAX_TYPE = O_CL5_PHENOL

Detailed Description

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