OEMMFFComplex

Attention

PRELIMINARY-IMAGE This is a preliminary API until Spring 2021 and may be improved based on user feedback. It is currently available in C++ and Python.

class OEMMFFComplex : public OEComplexFF

The OEMMFFComplex provides a predefined interface to use OEMMFF for all interactions in a host/guest complex.

The following methods are publicly inherited from OEFunc0:
The following methods are publicly inherited from OEFunc1:
The following methods are publicly inherited from OEMolFunc:
The following methods are publicly inherited from OEComplexFF:

Constructors

OEMMFFComplex(const OEMolMMFF::OEMMFFParams& params = OEMolMMFF::OEMMFFParams(),
              const OEMolPotential::OENonBondIntcsOptions& opts = OEMolPotential::OENonBondIntcsOptions())
OEMMFFComplex(const OEMMFFComplex&)

Default and copy constructors.