OEMMFFSheffield¶
Attention
This API is currently available in C++ and Python.
class OEMMFFSheffield : public OEMolPotential::OEGenericFF2
The OEMMFFSheffield
is a hybrid force field that combines the
OEMMFF
with the OESheffield
. This force field
is designed to be used exactly as that of OEMMFF
or a variation
of it, such as a truncated-OEMMFF, OEMMFF without electrostatics, or OEMMFF
with OESheffield
.

..seealso:
* :ref:`sub-section_MMFF-IEFF` section
* :ref:`section_mmff` section
- The following methods are publicly inherited from
OEFunc0
: - The following methods are publicly inherited from
OEFunc1
: - The following methods are publicly inherited from
OEFunc2
: - The following methods are publicly inherited from
OEMolFunc
: - The following methods are publicly inherited from
OEForceField
: - The following methods are publicly inherited from
OEGenericFF2
:
Constructors¶
OEMMFFSheffield()
Default constructor.
OEMMFFSheffield(const OEMMFFSheffieldOptions& options)
Creates the force field with user specified options.