CDPL.Biomol.MolecularGraphProperty Class Reference

Provides keys for built-in Chem.MolecularGraph properties. More...

Inheritance diagram for CDPL.Biomol.MolecularGraphProperty:

Static Public Attributes
	RESIDUE_CODE = CDPL.Base.LookupKey('RESIDUE_CODE')
	Specifies the residue code (three-letter code) of the residue described by the molecular graph. More...
	RESIDUE_SEQUENCE_NUMBER = CDPL.Base.LookupKey('RESIDUE_SEQUENCE_NUMBER')
	Specifies the residue sequence number of the residue described by the molecular graph. More...
	RESIDUE_INSERTION_CODE = CDPL.Base.LookupKey('RESIDUE_INSERTION_CODE')
	Specifies the residue insertion code of the residue described by the molecular graph. More...
	CHAIN_ID = CDPL.Base.LookupKey('CHAIN_ID')
	Specifies the identifier of the chain the molecular graph belongs to. More...
	MODEL_NUMBER = CDPL.Base.LookupKey('MODEL_NUMBER')
	Specifies the model number assigned to the molecular graph. More...
	PDB_DATA = CDPL.Base.LookupKey('PDB_DATA')
	Specifies the associated PDB data record. More...
	MMCIF_DATA = CDPL.Base.LookupKey('MMCIF_DATA')
	Specifies the associated mmCIF data record. More...

Detailed Description

Provides keys for built-in Chem.MolecularGraph properties.

Member Data Documentation

RESIDUE_CODE

CDPL.Biomol.MolecularGraphProperty.RESIDUE_CODE = CDPL.Base.LookupKey('RESIDUE_CODE')

static

Specifies the residue code (three-letter code) of the residue described by the molecular graph.

Value Type: std::string

RESIDUE_SEQUENCE_NUMBER

CDPL.Biomol.MolecularGraphProperty.RESIDUE_SEQUENCE_NUMBER = CDPL.Base.LookupKey('RESIDUE_SEQUENCE_NUMBER')

static

Specifies the residue sequence number of the residue described by the molecular graph.

Value Type: long

RESIDUE_INSERTION_CODE

CDPL.Biomol.MolecularGraphProperty.RESIDUE_INSERTION_CODE = CDPL.Base.LookupKey('RESIDUE_INSERTION_CODE')

static

Specifies the residue insertion code of the residue described by the molecular graph.

Value Type: char

CHAIN_ID

CDPL.Biomol.MolecularGraphProperty.CHAIN_ID = CDPL.Base.LookupKey('CHAIN_ID')

static

Specifies the identifier of the chain the molecular graph belongs to.

Value Type: std::string

MODEL_NUMBER

CDPL.Biomol.MolecularGraphProperty.MODEL_NUMBER = CDPL.Base.LookupKey('MODEL_NUMBER')

static

Specifies the model number assigned to the molecular graph.

Value Type: std::size_t

PDB_DATA

CDPL.Biomol.MolecularGraphProperty.PDB_DATA = CDPL.Base.LookupKey('PDB_DATA')

static

Specifies the associated PDB data record.

Value Type: Biomol.PDBData.SharedPointer

MMCIF_DATA

CDPL.Biomol.MolecularGraphProperty.MMCIF_DATA = CDPL.Base.LookupKey('MMCIF_DATA')

static

Specifies the associated mmCIF data record.

Value Type: Biomol.MMCIFData.SharedPointer

Since

1.2