OBFFCalculation Member List

This is the complete list of members for OBFFCalculation, including all inherited members.

aOBFFCalculation
bOBFFCalculation
cOBFFCalculation
Compute(bool gradients=true)OBFFCalculation [inline, virtual]
dOBFFCalculation
energyOBFFCalculation
GetEnergy()OBFFCalculation [inline, virtual]
GetGradient(OBAtom *atom)OBFFCalculation [inline, virtual]
gradaOBFFCalculation
gradbOBFFCalculation
gradcOBFFCalculation
graddOBFFCalculation
OBFFCalculation()OBFFCalculation [inline]
~OBFFCalculation()OBFFCalculation [inline, virtual]