OEExactShapeFunc

class OEExactShapeFunc : public OEShapeFunc

The OEExactShapeFunc class defines shape overlap between a reference object and a fit molecule, using the Exact method.

The following methods are publicly inherited from OEFunc0:

• operator()

• GetFComponents

• NumVar

The following methods are publicly inherited from OEFunc1:

• operator()

The following methods are publicly inherited from OEMolFunc:

• GetInteractions

• Setup

The following methods are publicly inherited from OEOverlapFuncBase:

• Overlap

• SetupFlex

• SetupRef

The following methods are publicly inherited from OEShapeFunc:

• GetShapeOptions

Constructors

OEExactShapeFunc()
OEExactShapeFunc(const OEShapeOptions&)
OEExactShapeFunc(const OEExactShapeFunc&)

Default and copy constructors.

Constructs an OEExactShapeFunc instance using the specified set of parameters.

operator=

OEExactShapeFunc &operator=(const OEExactShapeFunc &)

The assignment operator.