pele.amber.gmin_potential

Module source

Wrapper for GMIN Amber potential

class pele.amber.gmin_potential.GMINAmberPotential

Source

class GMINAmberPotential(GMINPotential):

GMIN amber potential

V(r) = Amber ff

GMINAmberPotential.copyToLocalCoords()

Source

def copyToLocalCoords(self, coords):

copy to local coords