Package ffx.openmm.drude
@ParametersAreNonnullByDefault
package ffx.openmm.drude
The Drude package includes Java classes that are analogues of the OpenMM C++ API
for the Charmm Drude model.
- Since:
- 1.0
- Author:
- Michael J. Schnieders
-
ClassesClassDescriptionThis class implements forces that are specific to Drude oscillators.A base class to encapsulate features common to Drude integrators.This Integrator simulates systems that include Drude particles.This Integrator simulates systems that include Drude particles.This is a leap-frog Verlet Integrator that simulates systems with Drude particles.