Source code for intermol.forces.lj_sigeps_nonbonded_type

import simtk.unit as units

from intermol.decorators import accepts_compatible_units
from abstract_nonbonded_type import AbstractNonbondedType


[docs]class LjSigepsNonbondedType(AbstractNonbondedType): __slots__ = ['sigma', 'epsilon', 'type'] @accepts_compatible_units(None, None, sigma=units.nanometers, epsilon=units.kilojoules_per_mole, type=None) def __init__(self, bondingtype1, bondingtype2, sigma=0.0 * units.nanometers, epsilon=0.0 * units.kilojoules_per_mole, type=False): AbstractNonbondedType.__init__(self, bondingtype1, bondingtype2, type) self.sigma = sigma self.epsilon = epsilon
[docs]class LjSigepsNonbonded(LjSigepsNonbondedType): """ stub documentation """ def __init__(self, atom1, atom2, bondingtype1=None, bondingtype2=None, sigma=0.0 * units.nanometers, epsilon=0.0 * units.kilojoules_per_mole, type=False): self.atom1 = atom1 self.atom2 = atom2 LjSigepsNonbondedType.__init__(self, bondingtype1, bondingtype2, sigma=sigma, epsilon=epsilon, type=type)