CDPL.Chem.AtomProperty Class Reference

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

Inheritance diagram for CDPL.Chem.AtomProperty:

Static Public Attributes
	NAME = CDPL.Base.LookupKey(id=2, name='NAME')
	SYMBOL = CDPL.Base.LookupKey(id=3, name='SYMBOL')
	TYPE = CDPL.Base.LookupKey(id=4, name='TYPE')
	FORMAL_CHARGE = CDPL.Base.LookupKey(id=5, name='FORMAL_CHARGE')
	ISOTOPE = CDPL.Base.LookupKey(id=6, name='ISOTOPE')
	RADICAL_TYPE = CDPL.Base.LookupKey(id=7, name='RADICAL_TYPE')
	HYBRIDIZATION = CDPL.Base.LookupKey(id=8, name='HYBRIDIZATION')
	RING_FLAG = CDPL.Base.LookupKey(id=9, name='RING_FLAG')
	AROMATICITY_FLAG = CDPL.Base.LookupKey(id=10, name='AROMATICITY_FLAG')
	UNPAIRED_ELECTRON_COUNT = CDPL.Base.LookupKey(id=11, name='UNPAIRED_ELECTRON_COUNT')
	IMPLICIT_HYDROGEN_COUNT = CDPL.Base.LookupKey(id=12, name='IMPLICIT_HYDROGEN_COUNT')
	COORDINATES_2D = CDPL.Base.LookupKey(id=13, name='COORDINATES_2D')
	COORDINATES_3D_ARRAY = CDPL.Base.LookupKey(id=14, name='COORDINATES_3D_ARRAY')
	MORGAN_NUMBER = CDPL.Base.LookupKey(id=15, name='MORGAN_NUMBER')
	CANONICAL_NUMBER = CDPL.Base.LookupKey(id=16, name='CANONICAL_NUMBER')
	CIP_PRIORITY = CDPL.Base.LookupKey(id=17, name='CIP_PRIORITY')
	SYMMETRY_CLASS = CDPL.Base.LookupKey(id=18, name='SYMMETRY_CLASS')
	STEREO_DESCRIPTOR = CDPL.Base.LookupKey(id=19, name='STEREO_DESCRIPTOR')
	STEREO_CENTER_FLAG = CDPL.Base.LookupKey(id=20, name='STEREO_CENTER_FLAG')
	CIP_CONFIGURATION = CDPL.Base.LookupKey(id=21, name='CIP_CONFIGURATION')
	MDL_PARITY = CDPL.Base.LookupKey(id=22, name='MDL_PARITY')
	MDL_DB_STEREO_CARE_FLAG = CDPL.Base.LookupKey(id=23, name='MDL_DB_STEREO_CARE_FLAG')
	SYBYL_TYPE = CDPL.Base.LookupKey(id=24, name='SYBYL_TYPE')
	MOL2_NAME = CDPL.Base.LookupKey(id=26, name='MOL2_NAME')
	MOL2_CHARGE = CDPL.Base.LookupKey(id=25, name='MOL2_CHARGE')
	MOL2_SUBSTRUCTURE_ID = CDPL.Base.LookupKey(id=27, name='MOL2_SUBSTRUCTURE_ID')
	MOL2_SUBSTRUCTURE_NAME = CDPL.Base.LookupKey(id=28, name='MOL2_SUBSTRUCTURE_NAME')
	MOL2_SUBSTRUCTURE_SUBTYPE = CDPL.Base.LookupKey(id=29, name='MOL2_SUBSTRUCTURE_SUBTYPE')
	MOL2_SUBSTRUCTURE_CHAIN = CDPL.Base.LookupKey(id=30, name='MOL2_SUBSTRUCTURE_CHAIN')
	REACTION_CENTER_STATUS = CDPL.Base.LookupKey(id=31, name='REACTION_CENTER_STATUS')
	ATOM_MAPPING_ID = CDPL.Base.LookupKey(id=32, name='ATOM_MAPPING_ID')
	MATCH_CONSTRAINTS = CDPL.Base.LookupKey(id=33, name='MATCH_CONSTRAINTS')
	MATCH_EXPRESSION = CDPL.Base.LookupKey(id=34, name='MATCH_EXPRESSION')
	MATCH_EXPRESSION_STRING = CDPL.Base.LookupKey(id=35, name='MATCH_EXPRESSION_STRING')
	COMPONENT_GROUP_ID = CDPL.Base.LookupKey(id=36, name='COMPONENT_GROUP_ID')

Detailed Description

Provides keys for built-in Chem.Atom properties.