Scilligence MolEngine Cheminformatics Toolkit (7.0)
Scilligence MolEngine Cheminformatics Toolkit (7.0)
Scilligence.MolEngine
Reaction Class
Reaction Methods
AddDefaultArrow Method
AddProduct Method
AddReactant Method
AddReagent Method
ClearRxnMapping Method
Clone Method
EqualizeBondLength Method
ExpandSuperAtoms Method
GetBound Method
GetFingerprints Method
GetRxnFile Method
GetStructureKeys Method
GetTexts Method
HasCoordinates Method
HasZCoordinates Method
NeedV3000 Method
ProductContains Method
ReactantContains Method
Read Method
ReadFile Method
ReadSMILES Method
Relayout Method
RemoveAtomMaps Method
RemoveHydrogens Method
SortByXCoordinates Method
ToSketch Method
TreatReagentAsReactant Method
Reaction
GetBound Method
Get the 3D bounds of the reaction
Namespace:
Scilligence.MolEngine
Assembly:
Scilligence.MolEngine (in Scilligence.MolEngine.dll) Version: 1.3.0.0 (7.0.0.39951)
Syntax
C#
Copy
public
override
Bound3D
GetBound
()
Return Value
Type:
Bound3D
3D bounds
See Also
Reference
Reaction Class
Scilligence.MolEngine Namespace