openmm

OpenMM tools

This module provides a number of extensions to the OpenMM simulation toolkit.

mdcraft.openmm.bond	Custom OpenMM bond potentials
mdcraft.openmm.file	Custom OpenMM topology and trajectory file readers and writers
mdcraft.openmm.pair	Custom OpenMM pair potentials
mdcraft.openmm.reporter	Custom OpenMM reporters
mdcraft.openmm.system	OpenMM system extensions and tools
mdcraft.openmm.topology	OpenMM topology transformations
mdcraft.openmm.unit	OpenMM physical constants and unit conversions
mdcraft.openmm.utility	OpenMM utility functions