Package ffx.numerics.multipole

Class QIMultipoleTensorTest

java.lang.Object

ffx.utilities.FFXTest

ffx.numerics.multipole.QIMultipoleTensorTest

public class QIMultipoleTensorTest
extends ffx.utilities.FFXTest

Parameterized Test of the MultipoleTensor class.

Since:

1.0

Author:

Michael J. Schnieders

Field Summary

Fields inherited from class ffx.utilities.FFXTest

ffxCI, ffxOpenMM

Constructor Summary

Constructors

Constructor	Description
QIMultipoleTensorTest(String info, int order, ffx.numerics.multipole.MultipoleTensor.OPERATOR operator)

Method Summary

Modifier and Type	Method	Description
void	codeGenerationTest()
static Collection<Object[]>	data()
void	finiteDifferenceTest()
void	multipoleTensorTest()
void	permanentMultipoleEnergyAndGradTest()
void	polarizationEnergyAndGradTest()

Methods inherited from class ffx.utilities.FFXTest

afterClass, afterTest, beforeClass, beforeTest, registerTemporaryDirectory

Methods inherited from class java.lang.Object

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

Constructor Details

QIMultipoleTensorTest

public QIMultipoleTensorTest(String info,
 int order,
 ffx.numerics.multipole.MultipoleTensor.OPERATOR operator)

Method Details

data

public static Collection<Object[]> data()

codeGenerationTest

public void codeGenerationTest()

permanentMultipoleEnergyAndGradTest

public void permanentMultipoleEnergyAndGradTest()

polarizationEnergyAndGradTest

public void polarizationEnergyAndGradTest()

finiteDifferenceTest

public void finiteDifferenceTest()

multipoleTensorTest

public void multipoleTensorTest()