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
	Specifies that the atom carries no BRICS label. More...
constexpr unsigned int	L1 = 1
	Specifies the BRICS atom label L1. More...
constexpr unsigned int	L2 = 2
	Specifies the BRICS atom label L2. More...
constexpr unsigned int	L3 = 3
	Specifies the BRICS atom label L3. More...
constexpr unsigned int	L4 = 4
	Specifies the BRICS atom label L4. More...
constexpr unsigned int	L5 = 5
	Specifies the BRICS atom label L5. More...
constexpr unsigned int	L6 = 6
	Specifies the BRICS atom label L6. More...
constexpr unsigned int	L7 = 7
	Specifies the BRICS atom label L7. More...
constexpr unsigned int	L8 = 8
	Specifies the BRICS atom label L8. More...
constexpr unsigned int	L9 = 9
	Specifies the BRICS atom label L9. More...
constexpr unsigned int	L10 = 10
	Specifies the BRICS atom label L10. More...
constexpr unsigned int	L11 = 11
	Specifies the BRICS atom label L11. More...
constexpr unsigned int	L12 = 12
	Specifies the BRICS atom label L12. More...
constexpr unsigned int	L13 = 13
	Specifies the BRICS atom label L13. More...
constexpr unsigned int	L14 = 14
	Specifies the BRICS atom label L14. More...
constexpr unsigned int	L15 = 15
	Specifies the BRICS atom label L15. More...
constexpr unsigned int	L16 = 16
	Specifies the BRICS atom label L16. More...

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

Specifies that the atom carries no BRICS label.

L1

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

constexpr

Specifies the BRICS atom label L1.

L2

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

constexpr

Specifies the BRICS atom label L2.

L3

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

constexpr

Specifies the BRICS atom label L3.

L4

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

constexpr

Specifies the BRICS atom label L4.

L5

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

constexpr

Specifies the BRICS atom label L5.

L6

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

constexpr

Specifies the BRICS atom label L6.

L7

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

constexpr

Specifies the BRICS atom label L7.

L8

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

constexpr

Specifies the BRICS atom label L8.

L9

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

constexpr

Specifies the BRICS atom label L9.

L10

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

constexpr

Specifies the BRICS atom label L10.

L11

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

constexpr

Specifies the BRICS atom label L11.

L12

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

constexpr

Specifies the BRICS atom label L12.

L13

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

constexpr

Specifies the BRICS atom label L13.

L14

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

constexpr

Specifies the BRICS atom label L14.

L15

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

constexpr

Specifies the BRICS atom label L15.

L16

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

constexpr

Specifies the BRICS atom label L16.