Package ffx.algorithms.groovy

Class DynamicsNVTTest

java.lang.Object

ffx.utilities.FFXTest

ffx.algorithms.misc.AlgorithmsTest

ffx.algorithms.groovy.DynamicsNVTTest

public class DynamicsNVTTest
extends AlgorithmsTest

Test NVT dynamics on a waterbox.

Author:

Hernan V. Bernabe

Field Summary

Fields inherited from class ffx.algorithms.misc.AlgorithmsTest

algorithmsScript, binding

Fields inherited from class ffx.utilities.FFXTest

ffxCI, ffxOpenMM, logger

Constructor Summary

Constructors

Constructor	Description
DynamicsNVTTest(String info, String filename, double finalTemp, double endTotalEnergy)

Method Summary

Modifier and Type	Method	Description
static Collection<Object[]>	data()
void	testDynamicsNVT()

Methods inherited from class ffx.algorithms.misc.AlgorithmsTest

afterTest, beforeClass, beforeTest, getResourceFile, getResourcePath

Methods inherited from class ffx.utilities.FFXTest

afterClass, registerTemporaryDirectory

Methods inherited from class java.lang.Object

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

Constructor Details

DynamicsNVTTest

public DynamicsNVTTest(String info,
 String filename,
 double finalTemp,
 double endTotalEnergy)

Method Details

data

public static Collection<Object[]> data()

testDynamicsNVT

public void testDynamicsNVT()