CDPL::Chem::BRICSAtomLabel Namespace Reference

Provides constants for the labeling of atoms in bonds matched by a BRICS fragmentation rule. More...

Variables
constexpr unsigned int	NONE = 0
constexpr unsigned int	L1 = 1
constexpr unsigned int	L2 = 2
constexpr unsigned int	L3 = 3
constexpr unsigned int	L4 = 4
constexpr unsigned int	L5 = 5
constexpr unsigned int	L6 = 6
constexpr unsigned int	L7 = 7
constexpr unsigned int	L8 = 8
constexpr unsigned int	L9 = 9
constexpr unsigned int	L10 = 10
constexpr unsigned int	L11 = 11
constexpr unsigned int	L12 = 12
constexpr unsigned int	L13 = 13
constexpr unsigned int	L14 = 14
constexpr unsigned int	L15 = 15
constexpr unsigned int	L16 = 16

Detailed Description

Provides constants for the labeling of atoms in bonds matched by a BRICS fragmentation rule.

See also

[BRICS]

Variable Documentation

NONE

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::NONE = 0

constexpr

L1

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L1 = 1

constexpr

L2

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L2 = 2

constexpr

L3

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L3 = 3

constexpr

L4

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L4 = 4

constexpr

L5

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L5 = 5

constexpr

L6

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L6 = 6

constexpr

L7

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L7 = 7

constexpr

L8

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L8 = 8

constexpr

L9

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L9 = 9

constexpr

L10

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L10 = 10

constexpr

L11

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L11 = 11

constexpr

L12

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L12 = 12

constexpr

L13

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L13 = 13

constexpr

L14

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L14 = 14

constexpr

L15

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L15 = 15

constexpr

L16

constexpr unsigned int CDPL::Chem::BRICSAtomLabel::L16 = 16

constexpr