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IMP Reference Guide  develop.36b5e40f34,2024/10/14
The Integrative Modeling Platform
atom/MolecularDynamics.h File Reference

Simple molecular dynamics optimizer. More...

#include <IMP/atom/atom_config.h>
#include "Simulator.h"
#include "atom_macros.h"
#include <IMP/Particle.h>
#include <IMP/Optimizer.h>
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Classes

class  IMP::atom::AngularVelocity
 A particle with angular velocity. More...
 
class  IMP::atom::LinearVelocity
 A particle with linear (XYZ) velocity. More...
 
class  IMP::atom::MolecularDynamics
 Simple molecular dynamics simulator. More...
 

Namespaces

 IMP
 Base functionality and abstract base classes for representation, scoring and sampling.
 
 IMP::atom
 Functionality for loading, creating, manipulating and scoring atomic structures.
 

Detailed Description

Simple molecular dynamics optimizer.

Copyright 2007-2022 IMP Inventors. All rights reserved.

Definition in file atom/MolecularDynamics.h.