RECAPRuleID.hpp File Reference

Definition of constants in namespace CDPL::Chem::RECAPRuleID. More...

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Namespaces
	CDPL
	The namespace of the Chemical Data Processing Library.
	CDPL::Chem
	Contains classes and functions related to chemistry.
	CDPL::Chem::RECAPRuleID
	Provides constants for the identification of RECAP fragmentation rules.

Variables
constexpr unsigned int	CDPL::Chem::RECAPRuleID::NONE = 0
	Specifies that no RECAP rule matched the bond. More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::AMIDE = 1
	Specifies the RECAP rule for amide bond cleavage. More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::ESTER = 2
	Specifies the RECAP rule for ester bond cleavage. More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::AMINE = 3
	Specifies the RECAP rule for amine bond cleavage. More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::UREA = 4
	Specifies the RECAP rule for urea bond cleavage. More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::ETHER = 5
	Specifies the RECAP rule for ether bond cleavage. More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::OLEFIN = 6
	Specifies the RECAP rule for olefinic-bond cleavage. More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::QUARTERNARY_N = 7
	Specifies the RECAP rule for quaternary-nitrogen bond cleavage. More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::AROMATIC_N_ALIPHATIC_C = 8
	Specifies the RECAP rule for aromatic-N to aliphatic-C bond cleavage. More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::LACTAM_N_ALIPHATIC_C = 9
	Specifies the RECAP rule for lactam-N to aliphatic-C bond cleavage. More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::AROMATIC_C_AROMATIC_C = 10
	Specifies the RECAP rule for aromatic-C to aromatic-C bond cleavage (biaryl). More...
constexpr unsigned int	CDPL::Chem::RECAPRuleID::SULFONAMIDE = 11
	Specifies the RECAP rule for sulfonamide bond cleavage. More...

Detailed Description

Definition of constants in namespace CDPL::Chem::RECAPRuleID.