Class Dynamics

java.lang.Object

ffx.utilities.FFXCommand

ffx.algorithms.cli.AlgorithmsCommand

ffx.realspace.commands.Dynamics

public class Dynamics
extends AlgorithmsCommand

The Real Space Dynamics script.
Usage:
ffxc realspace.Dynamics [options] <filename>

Field Summary

Fields inherited from class AlgorithmsCommand

activeAssembly, algorithmFunctions, algorithmListener, baseDir

Fields inherited from class FFXCommand

args, binding, color, help, logger, parseResult, version

Constructor Summary

Constructors

Constructor	Description
Dynamics()	Dynamics constructor.
Dynamics(FFXBinding binding)	Dynamics constructor.
Dynamics(String[] args)	Dynamics constructor that sets the command line arguments.

Method Summary

Modifier and Type	Method	Description
List<Potential>	getPotentials()	Returns a List of all Potential objects associated with this script.
Dynamics	run()	Execute this Command.

Methods inherited from class AlgorithmsCommand

destroyPotentials, getActiveAssemblies, getActiveAssembly, getPotentialsFromAssemblies, init, saveDirFile, setBaseDir, updateTitle

Methods inherited from class FFXCommand

getCommand, helpString, listCommands, setBinding

Methods inherited from class Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Constructor Details

Dynamics

public Dynamics()

Dynamics constructor.

Dynamics

public Dynamics(String[] args)

Dynamics constructor that sets the command line arguments.

Parameters:

args - Command line arguments.

Dynamics

public Dynamics(FFXBinding binding)

Dynamics constructor.

Parameters:

binding - The Binding to use.

Method Details

run

public Dynamics run()

Description copied from class: FFXCommand

Execute this Command.

Overrides:

run in class FFXCommand

Returns:

The current FFXCommand.

getPotentials

public List<Potential> getPotentials()

Description copied from class: AlgorithmsCommand

Returns a List of all Potential objects associated with this script.

Overrides:

getPotentials in class AlgorithmsCommand

Returns:

All Potentials. Sometimes empty, never null.