Source code for intermol.forces.harmonic_potential_bond_type

import simtk.unit as units

from intermol.decorators import accepts_compatible_units
from abstract_bond_type import AbstractBondType


[docs]class HarmonicPotentialBondType(AbstractBondType): __slots__ = ['length', 'k', 'order', 'c'] @accepts_compatible_units(None, None, length=units.nanometers, k=units.kilojoules_per_mole * units.nanometers ** (-2), order=None, c=None) def __init__(self, bondingtype1, bondingtype2, length=0.0 * units.nanometers, k=0.0 * units.kilojoules_per_mole * units.nanometers ** (-2), order=1, c=False): AbstractBondType.__init__(self, bondingtype1, bondingtype2, order, c) self.length = length self.k = k
[docs]class HarmonicPotentialBond(HarmonicPotentialBondType): """ stub documentation """ def __init__(self, atom1, atom2, bondingtype1=None, bondingtype2=None, length=0.0 * units.nanometers, k=0.0 * units.kilojoules_per_mole * units.nanometers ** (-2), order=1, c=False): self.atom1 = atom1 self.atom2 = atom2 HarmonicPotentialBondType.__init__(self, bondingtype1, bondingtype2, length=length, k=k, order=order, c=c)