gmx::ArrayRef<const NbnxnPairlistCpu> pairlists = pairlistSet.cpuLists();
- auto shiftVecPointer = as_rvec_array(shiftVectors.data());
+ const auto* shiftVecPointer = as_rvec_array(shiftVectors.data());
- int gmx_unused nthreads = gmx_omp_nthreads_get(emntNonbonded);
+ int gmx_unused nthreads = gmx_omp_nthreads_get(ModuleMultiThread::Nonbonded);
wallcycle_sub_start(wcycle, WallCycleSubCounter::NonbondedClear);
#pragma omp parallel for schedule(static) num_threads(nthreads)
for (gmx::index nb = 0; nb < pairlists.ssize(); nb++)
gmx::ArrayRef<real> energygrp_elec = enerd->grpp.energyGroupPairTerms[NonBondedEnergyTerms::CoulombSR];
gmx::ArrayRef<real> energygrp_vdw = enerd->grpp.energyGroupPairTerms[NonBondedEnergyTerms::LJSR];
- GMX_ASSERT(gmx_omp_nthreads_get(emntNonbonded) == nbl_fep.ssize(),
+ GMX_ASSERT(gmx_omp_nthreads_get(ModuleMultiThread::Nonbonded) == nbl_fep.ssize(),
"Number of lists should be same as number of NB threads");
wallcycle_sub_start(wcycle_, WallCycleSubCounter::NonbondedFep);