OEFF14SBParsleyComplex

Attention

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

class OEFF14SBParsleyComplex : public OEComplexFF

The OEFF14SBParsleyComplex represents a force field for a protein-ligand complex system, where the interactions are described with OEFF14SBParsleyParams.

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

OEFF14SBParsleyComplex(const OEMolPotential::OENonBondIntcsOptions& opts = OEMolPotential::OENonBondIntcsOptions())
OEFF14SBParsleyComplex(const OEFF14SBParsleyComplex&)

Default and copy constructors.