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IMP Reference Guide  2.13.0
The Integrative Modeling Platform
MolecularDynamicsMover.h File Reference

A modifier which perturbs XYZs or Nuisances with a constant energy MD simulation. More...

#include <IMP/isd/isd_config.h>
#include <IMP/core/MonteCarloMover.h>
#include <IMP/isd/MolecularDynamics.h>
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Classes

class  IMP::isd::MolecularDynamicsMover
 Modify a set of continuous variables using a MD simulation. More...
 

Namespaces

 IMP
 Base functionality and abstract base classes for representation, scoring and sampling.
 
 IMP::isd
 Inferential scoring building on methods developed as part of the Inferential Structure Determination software (ISD).
 

Detailed Description

A modifier which perturbs XYZs or Nuisances with a constant energy MD simulation.

Copyright 2007-2020 IMP Inventors. All rights reserved.

Definition in file MolecularDynamicsMover.h.