{
SettleData settled(testData->mtop_);
- settled.setConstraints(testData->idef_->il[F_SETTLE], testData->numAtoms_,
- testData->masses_.data(), testData->inverseMasses_.data());
+ settled.setConstraints(testData->idef_->il[F_SETTLE],
+ testData->numAtoms_,
+ testData->masses_.data(),
+ testData->inverseMasses_.data());
bool errorOccured;
int numThreads = 1;
int threadIndex = 0;
- csettle(settled, numThreads, threadIndex, &pbc, testData->x_.arrayRefWithPadding(),
- testData->xPrime_.arrayRefWithPadding(), testData->reciprocalTimeStep_,
+ csettle(settled,
+ numThreads,
+ threadIndex,
+ &pbc,
+ testData->x_.arrayRefWithPadding(),
+ testData->xPrime_.arrayRefWithPadding(),
+ testData->reciprocalTimeStep_,
updateVelocities ? testData->v_.arrayRefWithPadding() : ArrayRefWithPadding<RVec>(),
- calcVirial, testData->virial_, &errorOccured);
+ calcVirial,
+ testData->virial_,
+ &errorOccured);
EXPECT_FALSE(errorOccured) << testDescription;
}