Surefire Report
Summary
[Summary] [Package List] [Test Cases]
Tests | Errors | Failures | Skipped | Success Rate | Time |
---|---|---|---|---|---|
492 | 0 | 0 | 0 | 100% | 390.153 |
Note: failures are anticipated and checked for with assertions while errors are unanticipated.
Package List
[Summary] [Package List] [Test Cases]
Package | Tests | Errors | Failures | Skipped | Success Rate | Time |
---|---|---|---|---|---|---|
ffx.potential.nonbonded | 1 | 0 | 0 | 0 | 100% | 0.192 |
ffx.potential.utils | 3 | 0 | 0 | 0 | 100% | 0.116 |
ffx.xray.parsers | 6 | 0 | 0 | 0 | 100% | 3.537 |
ffx.numerics.spline | 14 | 0 | 0 | 0 | 100% | 0 |
ffx.numerics.integrate | 7 | 0 | 0 | 0 | 100% | 0.095 |
ffx.algorithms.groovy | 81 | 0 | 0 | 0 | 100% | 121.502 |
ffx.numerics.func1d | 2 | 0 | 0 | 0 | 100% | 0 |
ffx.numerics.multipole | 60 | 0 | 0 | 0 | 100% | 0.083 |
ffx.numerics.special | 38 | 0 | 0 | 0 | 100% | 0.004 |
ffx.xray | 20 | 0 | 0 | 0 | 100% | 30.775 |
ffx.realspace | 1 | 0 | 0 | 0 | 100% | 0.466 |
ffx.potential.parsers | 1 | 0 | 0 | 0 | 100% | 0.567 |
ffx.numerics.math | 10 | 0 | 0 | 0 | 100% | 0.01 |
ffx.numerics.fft | 43 | 0 | 0 | 0 | 100% | 0.393 |
ffx.crystal | 13 | 0 | 0 | 0 | 100% | 0.392 |
ffx.utilities | 2 | 0 | 0 | 0 | 100% | 0.03 |
ffx.potential.groovy | 151 | 0 | 0 | 0 | 100% | 212.574 |
ffx.algorithms.optimize | 16 | 0 | 0 | 0 | 100% | 18.667 |
ffx.potential.bonded | 23 | 0 | 0 | 0 | 100% | 0.75 |
Note: package statistics are not computed recursively, they only sum up all of its testsuites numbers.
ffx.potential.nonbonded
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
NeckIntegralTest | 1 | 0 | 0 | 0 | 100% | 0.192 |
ffx.potential.utils
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
SwitchFunctionTest | 3 | 0 | 0 | 0 | 100% | 0.116 |
ffx.xray.parsers
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
CIFFilterTest | 2 | 0 | 0 | 0 | 100% | 1.343 |
![]() |
MTZFilterTest | 4 | 0 | 0 | 0 | 100% | 2.194 |
ffx.numerics.spline
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
UniformBSplineTest | 14 | 0 | 0 | 0 | 100% | 0 |
ffx.numerics.integrate
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
Integrate1DTest | 6 | 0 | 0 | 0 | 100% | 0.095 |
![]() |
IntegrationTest | 1 | 0 | 0 | 0 | 100% | 0 |
ffx.algorithms.groovy
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
SuperposeCrystalsTest | 19 | 0 | 0 | 0 | 100% | 2.774 |
![]() |
DynamicsInitVelocitiesTest | 1 | 0 | 0 | 0 | 100% | 0.835 |
![]() |
BARFilesTest | 2 | 0 | 0 | 0 | 100% | 0.063 |
![]() |
MinimizeCrystalsTest | 5 | 0 | 0 | 0 | 100% | 7.16 |
![]() |
ClusteringTest | 2 | 0 | 0 | 0 | 100% | 0.115 |
![]() |
SimulatedAnnealingTest | 1 | 0 | 0 | 0 | 100% | 6 |
![]() |
DynamicsBeemanBerendsenTest | 1 | 0 | 0 | 0 | 100% | 0.466 |
![]() |
ThermodynamicsTest | 21 | 0 | 0 | 0 | 100% | 1.146 |
![]() |
ManyBodyTest | 7 | 0 | 0 | 0 | 100% | 80.532 |
![]() |
DynamicsRESPANVETest | 1 | 0 | 0 | 0 | 100% | 1.451 |
![]() |
DynamicsNVTTest | 1 | 0 | 0 | 0 | 100% | 16.949 |
![]() |
MinimizeTest | 3 | 0 | 0 | 0 | 100% | 1.176 |
![]() |
BARDualTopologyTest | 2 | 0 | 0 | 0 | 100% | 0.069 |
![]() |
DynamicsOpenMMRESPANVETest | 1 | 0 | 0 | 0 | 100% | 0.214 |
![]() |
BARSingleTopologyTest | 2 | 0 | 0 | 0 | 100% | 0.07 |
![]() |
DynamicsStochasticTest | 9 | 0 | 0 | 0 | 100% | 1.679 |
![]() |
DynamicsNVETest | 2 | 0 | 0 | 0 | 100% | 0.788 |
![]() |
DynamicsOpenMMStochasticTest | 1 | 0 | 0 | 0 | 100% | 0.015 |
ffx.numerics.func1d
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
QuasiLinearSwitchTest | 2 | 0 | 0 | 0 | 100% | 0 |
ffx.numerics.multipole
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
QIMultipoleTensorTest | 15 | 0 | 0 | 0 | 100% | 0.013 |
![]() |
GKTensorQITest | 12 | 0 | 0 | 0 | 100% | 0.003 |
![]() |
GlobalMultipoleTensorTest | 15 | 0 | 0 | 0 | 100% | 0.065 |
![]() |
MultipoleTensorTest | 6 | 0 | 0 | 0 | 100% | 0.001 |
![]() |
GKTensorGlobalTest | 12 | 0 | 0 | 0 | 100% | 0.001 |
ffx.numerics.special
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
ErfTest | 12 | 0 | 0 | 0 | 100% | 0.001 |
![]() |
ModifiedBesselTest | 26 | 0 | 0 | 0 | 100% | 0.003 |
ffx.xray
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
CrystalReciprocalSpaceTest | 2 | 0 | 0 | 0 | 100% | 5.363 |
![]() |
FormFactorTest | 2 | 0 | 0 | 0 | 100% | 0 |
![]() |
XRayMinimizeTest | 14 | 0 | 0 | 0 | 100% | 25.332 |
![]() |
FiniteDifferenceTest | 1 | 0 | 0 | 0 | 100% | 0.016 |
![]() |
XRayManyBodyTest | 1 | 0 | 0 | 0 | 100% | 0.064 |
ffx.realspace
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
RealspaceManyBodyTest | 1 | 0 | 0 | 0 | 100% | 0.466 |
ffx.potential.parsers
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
ForceFieldFilterTest | 1 | 0 | 0 | 0 | 100% | 0.567 |
ffx.numerics.math
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
SquareRootTest | 10 | 0 | 0 | 0 | 100% | 0.01 |
ffx.numerics.fft
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
Real3DTest | 4 | 0 | 0 | 0 | 100% | 0.038 |
![]() |
Complex3DParallelTest | 8 | 0 | 0 | 0 | 100% | 0.15 |
![]() |
Complex3DTest | 4 | 0 | 0 | 0 | 100% | 0.044 |
![]() |
Real3DParallelTest | 8 | 0 | 0 | 0 | 100% | 0.135 |
![]() |
ComplexTest | 16 | 0 | 0 | 0 | 100% | 0.026 |
![]() |
RealTest | 3 | 0 | 0 | 0 | 100% | 0 |
ffx.crystal
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
ReflectionListTest | 6 | 0 | 0 | 0 | 100% | 0.377 |
![]() |
CrystalVolumeDerivativeTest | 7 | 0 | 0 | 0 | 100% | 0.015 |
ffx.utilities
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
Hybrid36Test | 2 | 0 | 0 | 0 | 100% | 0.03 |
ffx.potential.groovy
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
SaveAsPDBTest | 2 | 0 | 0 | 0 | 100% | 0.229 |
![]() |
BiotypeTest | 2 | 0 | 0 | 0 | 100% | 0.223 |
![]() |
OPLSEnergyTest | 15 | 0 | 0 | 0 | 100% | 4.436 |
![]() |
XYZtoQETest | 2 | 0 | 0 | 0 | 100% | 0.175 |
![]() |
MoveIntoUnitCellTest | 2 | 0 | 0 | 0 | 100% | 0.242 |
![]() |
PhGradientTest | 2 | 0 | 0 | 0 | 100% | 3.083 |
![]() |
TimerTest | 2 | 0 | 0 | 0 | 100% | 6.499 |
![]() |
VolumeTest | 19 | 0 | 0 | 0 | 100% | 16.197 |
![]() |
SaveAsP1Test | 2 | 0 | 0 | 0 | 100% | 2.813 |
![]() |
SolvatorTest | 4 | 0 | 0 | 0 | 100% | 1.738 |
![]() |
EnergyTest | 76 | 0 | 0 | 0 | 100% | 103.049 |
![]() |
SaveAsXYZTest | 2 | 0 | 0 | 0 | 100% | 0.355 |
![]() |
PrepareSpaceGroupsTest | 4 | 0 | 0 | 0 | 100% | 29.507 |
![]() |
Frac2CartTest | 2 | 0 | 0 | 0 | 100% | 0.171 |
![]() |
ImportCIFTest | 9 | 0 | 0 | 0 | 100% | 0.82 |
![]() |
LambdaGradientTest | 4 | 0 | 0 | 0 | 100% | 42.868 |
![]() |
Cart2FracTest | 2 | 0 | 0 | 0 | 100% | 0.169 |
ffx.algorithms.optimize
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
RotamerOptimizationTest | 16 | 0 | 0 | 0 | 100% | 18.667 |
ffx.potential.bonded
Class | Tests | Errors | Failures | Skipped | Success Rate | Time | |
---|---|---|---|---|---|---|---|
![]() |
AngleTest | 2 | 0 | 0 | 0 | 100% | 0 |
![]() |
MSNodeTest | 3 | 0 | 0 | 0 | 100% | 0 |
![]() |
TorsionTest | 2 | 0 | 0 | 0 | 100% | 0 |
![]() |
LoopClosureTest | 1 | 0 | 0 | 0 | 100% | 0.75 |
![]() |
BondTest | 6 | 0 | 0 | 0 | 100% | 0 |
![]() |
AtomTest | 9 | 0 | 0 | 0 | 100% | 0 |
Test Cases
[Summary] [Package List] [Test Cases]
Hybrid36Test
![]() |
testDecode | 0.001 |
![]() |
testEncode | 0.015 |
ErfTest
![]() |
testErf[0] | 0 |
![]() |
testErfc[0] | 0 |
![]() |
testErf[1] | 0 |
![]() |
testErfc[1] | 0 |
![]() |
testErf[2] | 0 |
![]() |
testErfc[2] | 0 |
![]() |
testErf[3] | 0 |
![]() |
testErfc[3] | 0 |
![]() |
testErf[4] | 0 |
![]() |
testErfc[4] | 0 |
![]() |
testErf[5] | 0 |
![]() |
testErfc[5] | 0 |
Real3DTest
![]() |
testConvolution[0] | 0.009 |
![]() |
testFft[0] | 0.008 |
![]() |
testConvolution[1] | 0.01 |
![]() |
testFft[1] | 0.01 |
Complex3DParallelTest
![]() |
testConvolution[0] | 0.025 |
![]() |
testFft[0] | 0.031 |
![]() |
testConvolution[1] | 0.024 |
![]() |
testFft[1] | 0.015 |
![]() |
testConvolution[2] | 0.013 |
![]() |
testFft[2] | 0.015 |
![]() |
testConvolution[3] | 0.015 |
![]() |
testFft[3] | 0.011 |
Complex3DTest
![]() |
testConvolution[0] | 0.016 |
![]() |
testFft[0] | 0.01 |
![]() |
testConvolution[1] | 0.013 |
![]() |
testFft[1] | 0.004 |
QIMultipoleTensorTest
Real3DParallelTest
![]() |
testConvolution[0] | 0.023 |
![]() |
testFft[0] | 0.021 |
![]() |
testConvolution[1] | 0.018 |
![]() |
testFft[1] | 0.014 |
![]() |
testConvolution[2] | 0.012 |
![]() |
testFft[2] | 0.013 |
![]() |
testConvolution[3] | 0.017 |
![]() |
testFft[3] | 0.015 |
QuasiLinearSwitchTest
![]() |
testPoints[0] | 0 |
![]() |
testPoints[1] | 0 |
GKTensorQITest
GlobalMultipoleTensorTest
SquareRootTest
MultipoleTensorTest
![]() |
tensorCountTest[0] | 0 |
![]() |
tensorIndexTest[0] | 0 |
![]() |
tensorCountTest[1] | 0 |
![]() |
tensorIndexTest[1] | 0 |
![]() |
tensorCountTest[2] | 0 |
![]() |
tensorIndexTest[2] | 0 |
ComplexTest
GKTensorGlobalTest
Integrate1DTest
![]() |
castToDoubleSetTest | 0.014 |
![]() |
testSinCosine | 0.049 |
![]() |
parallelTest | 0.016 |
![]() |
polynomialTest | 0.005 |
![]() |
testByBinIntegral | 0.007 |
![]() |
polynomialGrinderTest | 0.003 |
ModifiedBesselTest
IntegrationTest
![]() |
integrationTest | 0 |
UniformBSplineTest
RealTest
![]() |
testFft[0] | 0 |
![]() |
testFft[1] | 0 |
![]() |
testFft[2] | 0 |
ReflectionListTest
![]() |
testreflections[0] | 0.221 |
![]() |
testsize[0] | 0.102 |
![]() |
testreflections[1] | 0.011 |
![]() |
testsize[1] | 0.012 |
![]() |
testreflections[2] | 0.012 |
![]() |
testsize[2] | 0.01 |
CrystalVolumeDerivativeTest
SaveAsPDBTest
![]() |
testSaveAsPDBHelp | 0.029 |
![]() |
testSaveAsPDB | 0.198 |
AngleTest
![]() |
Angle_getCommonBond | 0 |
![]() |
Angle_getOtherBond | 0 |
ForceFieldFilterTest
![]() |
testParse | 0.562 |
BiotypeTest
![]() |
testBiotype | 0.188 |
![]() |
testBiotypeHelp | 0.034 |
OPLSEnergyTest
XYZtoQETest
![]() |
testXYZtoQEHelp | 0.03 |
![]() |
testXYZtoQE | 0.143 |
MoveIntoUnitCellTest
![]() |
testMoveIntoUnitCell | 0.211 |
![]() |
testMoveIntoUnitCellHelp | 0.03 |
PhGradientTest
![]() |
testEndStateEnergyAndGradient[0] | 1.749 |
![]() |
testEndStateEnergyAndGradient[1] | 1.332 |
TimerTest
![]() |
testTimer | 6.465 |
![]() |
testTimerHelp | 0.033 |
VolumeTest
SaveAsP1Test
![]() |
testSaveAsP1 | 2.781 |
![]() |
testSaveAsP1Help | 0.03 |
SolvatorTest
![]() |
testSolvator[0] | 0.032 |
![]() |
testSolvator[1] | 0.68 |
![]() |
testSolvator[2] | 0.572 |
![]() |
testSolvator[3] | 0.451 |
SwitchFunctionTest
![]() |
testPowerInterpolation | 0.056 |
![]() |
multSwitchTest | 0.009 |
![]() |
trigTest | 0.049 |
MSNodeTest
![]() |
MSNode_equals | 0 |
![]() |
MSNode_constructor | 0 |
![]() |
MSNode_destroy | 0 |
EnergyTest
SaveAsXYZTest
![]() |
testSaveAsXYZHelp | 0.039 |
![]() |
testSaveAsXYZ | 0.314 |
TorsionTest
![]() |
Torsion_constructor2 | 0 |
![]() |
Torsion_constructor | 0 |
LoopClosureTest
![]() |
loopTest[0] | 0.749 |
PrepareSpaceGroupsTest
![]() |
testPrepareSpaceGroups | 14.86 |
![]() |
testPrepareSpaceGroupsAChiral | 10.773 |
![]() |
testPrepareSpaceGroupHelp | 0.039 |
![]() |
testPrepareSpaceGroupsChiral | 3.832 |
Frac2CartTest
![]() |
testFrac2CartHelp | 0.033 |
![]() |
testFrac2Cart | 0.137 |
BondTest
![]() |
Bond_formsAngleWith | 0 |
![]() |
Bond_getCommonAtom | 0 |
![]() |
Bond_constructor | 0 |
![]() |
Bond_update | 0 |
![]() |
Bond_getOtherAtom2 | 0 |
![]() |
Bond_getOtherAtom | 0 |
ImportCIFTest
LambdaGradientTest
![]() |
testLambdaGradientSymOp | 25.965 |
![]() |
testLambdaGradient | 5.277 |
![]() |
testLambdaGradientHelp | 0.053 |
![]() |
testLambdaGradientIntermolecularSoftcore | 11.572 |
NeckIntegralTest
![]() |
testSettingConstants | 0.19 |
Cart2FracTest
![]() |
testCart2FractHelp | 0.039 |
![]() |
testCart2Frac | 0.129 |
AtomTest
![]() |
Atom_constructor3 | 0 |
![]() |
Atom_constructor4 | 0 |
![]() |
Atom_constructor | 0 |
![]() |
Atom_getBond | 0 |
![]() |
Atom_addTrajectoryCoords | 0 |
![]() |
Atom_equals | 0 |
![]() |
Atom_getNumBonds | 0 |
![]() |
Atom_destroy | 0 |
![]() |
Atom_isBonded | 0 |
SuperposeCrystalsTest
DynamicsInitVelocitiesTest
![]() |
testDynamicsInitVelocities[0] | 0.834 |
BARFilesTest
![]() |
testBARHelp | 0.031 |
![]() |
testBARFiles | 0.03 |
MinimizeCrystalsTest
![]() |
testCrystalMinFractional | 1.797 |
![]() |
testCrystalMinHelp | 0.044 |
![]() |
testCrystalMinCoords | 1.038 |
![]() |
testCrystalMinConvergenceCriteria | 2.347 |
![]() |
testCrystalMinIterations | 1.932 |
ClusteringTest
![]() |
testClusterHelp | 0.027 |
![]() |
testBaseCluster | 0.087 |
SimulatedAnnealingTest
![]() |
testSimulatedAnnealing[0] | 5.997 |
DynamicsBeemanBerendsenTest
![]() |
testDynamicsBeemanBerendsen[0] | 0.465 |
ThermodynamicsTest
ManyBodyTest
![]() |
testManyBodyBoxOptimization | 13.94 |
![]() |
testManyBodyBoxRestart | 7.203 |
![]() |
testManyBodyRestart | 0.832 |
![]() |
testManyBodyTitration | 9.43 |
![]() |
testManyBodyGlobal | 31.851 |
![]() |
testManyBodyMonteCarlo | 17.222 |
![]() |
testManyBodyHelp | 0.052 |
DynamicsRESPANVETest
![]() |
testRESPANVE[0] | 1.449 |
DynamicsNVTTest
![]() |
testDynamicsNVT[0] | 16.946 |
MinimizeTest
![]() |
testMinimizeIterations | 0.531 |
![]() |
testMinimizeConvergenceCriteria | 0.607 |
![]() |
testMinimizeHelp | 0.037 |
BARDualTopologyTest
![]() |
testBARHelp | 0.04 |
![]() |
testBAR | 0.028 |
DynamicsOpenMMRESPANVETest
![]() |
testDynamicsOpenMMRESPANVE[0] | 0.207 |
BARSingleTopologyTest
![]() |
testBARHelp | 0.045 |
![]() |
testBAR | 0.021 |
DynamicsStochasticTest
RotamerOptimizationTest
DynamicsNVETest
![]() |
testDynamicsNVE[0] | 0.747 |
![]() |
testDynamicsHelp[0] | 0.041 |
DynamicsOpenMMStochasticTest
![]() |
testDynamicsOpenMMStochastic[0] | 0.014 |
CIFFilterTest
![]() |
testCIFFilter2DRM | 0.334 |
![]() |
testCIFFilter3DYC | 1.007 |
CrystalReciprocalSpaceTest
![]() |
test1NSFPermanent | 2.88 |
![]() |
test1N7SPermanent | 2.477 |
FormFactorTest
![]() |
testCarbonfrho | 0 |
![]() |
testCarbonFF | 0 |
XRayMinimizeTest
FiniteDifferenceTest
![]() |
testFiniteDifferences[0] | 0.014 |
RealspaceManyBodyTest
![]() |
testManyBodyHelp | 0.462 |
MTZFilterTest
![]() |
testMTZParams | 0.954 |
![]() |
testMTZReflectionList | 0.108 |
![]() |
testMTZReadFile | 0.583 |
![]() |
testMTZHKL | 0.547 |
XRayManyBodyTest
![]() |
testManyBodyHelp | 0.063 |