}
/* Collect the charge group indices on the master */
- dd_gatherv(dd, atomGroups.size() * sizeof(int), atomGroups.data(),
+ dd_gatherv(dd,
+ atomGroups.size() * sizeof(int),
+ atomGroups.data(),
DDMASTER(dd) ? ma->intBuffer.data() : nullptr,
DDMASTER(dd) ? ma->intBuffer.data() + dd->nnodes : nullptr,
DDMASTER(dd) ? ma->atomGroups.data() : nullptr);
#if GMX_MPI
const int numHomeAtoms = dd->comm->atomRanges.numHomeAtoms();
MPI_Send(const_cast<void*>(static_cast<const void*>(lv.data())),
- numHomeAtoms * sizeof(rvec), MPI_BYTE, dd->masterrank, dd->rank, dd->mpi_comm_all);
+ numHomeAtoms * sizeof(rvec),
+ MPI_BYTE,
+ dd->masterrank,
+ dd->rank,
+ dd->mpi_comm_all);
#endif
}
else
}
#if GMX_MPI
- MPI_Recv(ma.rvecBuffer.data(), domainGroups.numAtoms * sizeof(rvec), MPI_BYTE, rank,
- rank, dd->mpi_comm_all, MPI_STATUS_IGNORE);
+ MPI_Recv(ma.rvecBuffer.data(),
+ domainGroups.numAtoms * sizeof(rvec),
+ MPI_BYTE,
+ rank,
+ rank,
+ dd->mpi_comm_all,
+ MPI_STATUS_IGNORE);
#endif
int localAtom = 0;
for (const int& globalAtom : domainGroups.atomGroups)
}
const int numHomeAtoms = dd->comm->atomRanges.numHomeAtoms();
- dd_gatherv(dd, numHomeAtoms * sizeof(rvec), lv.data(), recvCounts, displacements,
+ dd_gatherv(dd,
+ numHomeAtoms * sizeof(rvec),
+ lv.data(),
+ recvCounts,
+ displacements,
DDMASTER(dd) ? dd->ma->rvecBuffer.data() : nullptr);
if (DDMASTER(dd))
if (state_local->flags & (1 << estX))
{
auto globalXRef = state ? state->x : gmx::ArrayRef<gmx::RVec>();
- dd_collect_vec(dd, state_local->ddp_count, state_local->ddp_count_cg_gl, state_local->cg_gl,
- state_local->x, globalXRef);
+ dd_collect_vec(dd,
+ state_local->ddp_count,
+ state_local->ddp_count_cg_gl,
+ state_local->cg_gl,
+ state_local->x,
+ globalXRef);
}
if (state_local->flags & (1 << estV))
{
auto globalVRef = state ? state->v : gmx::ArrayRef<gmx::RVec>();
- dd_collect_vec(dd, state_local->ddp_count, state_local->ddp_count_cg_gl, state_local->cg_gl,
- state_local->v, globalVRef);
+ dd_collect_vec(dd,
+ state_local->ddp_count,
+ state_local->ddp_count_cg_gl,
+ state_local->cg_gl,
+ state_local->v,
+ globalVRef);
}
if (state_local->flags & (1 << estCGP))
{
auto globalCgpRef = state ? state->cg_p : gmx::ArrayRef<gmx::RVec>();
- dd_collect_vec(dd, state_local->ddp_count, state_local->ddp_count_cg_gl, state_local->cg_gl,
- state_local->cg_p, globalCgpRef);
+ dd_collect_vec(dd,
+ state_local->ddp_count,
+ state_local->ddp_count_cg_gl,
+ state_local->cg_gl,
+ state_local->cg_p,
+ globalCgpRef);
}
}