bond

Custom OpenMM bond potentials

This module contains implementations of commonly used bond potentials that are not available in OpenMM, such as the finite extension nonlinear elastic (FENE) potential. Generally, the bond potentials are named after their LAMMPS bond_style counterparts, if available.

Functions

fene

Implements the finite extensible nonlinear elastic (FENE) potential used for bead-spring polymer models.