Attribute
|
Type
|
Multiplicity
|
Description
|
name
|
Word
|
1..1
|
Name of corresponding ChemComp.ChemAtom. Part of the key for the corresponding ChemComp.ChemAtom
|
partialCharge
|
Float
|
1..1
|
partial charge value
|
serial
|
Int
|
1..1
|
Serial number of object. Serves as object main key. Serial numbers of deleted objects are not re-used. Serial numbers can only be set by the implementation. Values are in practice always positive, since negative values are interpreted as a signal to set the next free serial
|
subType
|
Int
|
1..1
|
Subtype of AbstractChemAtom, used to distinguish Atoms with the same names but different characteristics, to be used in diferent ChemCompVars. Part of the key for the corresponding ChemComp.ChemAtom
|
validVegaTypes
|
Line
|
0..*
|
VegaTypes accepted for ChemAtom in order for the partialCharge to be valid. This parameters is only set for atoms close to out-of-ChemComp links, where the atoms in the linked-to ChemComp may make a difference. Note that this is the full Vega type, including several shells of neighbours, not the shortVegaType kept in ChemComp.ChemAtom
|
Inherited Attributes (not in package):
applicationData,
className,
fieldNames,
inConstructor,
isDeleted,
metaclass,
packageName,
packageShortName,
qualifiedName
|