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Merge release-5-0 into master
[alexxy/gromacs.git]
/
src
/
gromacs
/
mdlib
/
nbnxn_kernels
/
nbnxn_kernel_ref.c
diff --git
a/src/gromacs/mdlib/nbnxn_kernels/nbnxn_kernel_ref.c
b/src/gromacs/mdlib/nbnxn_kernels/nbnxn_kernel_ref.c
index 3db03bbec59c7f76f080ef9322b77f3cf2ac3cdc..4cad2a2f5637ba5b410af8db8ca1225cc441d1a6 100644
(file)
--- a/
src/gromacs/mdlib/nbnxn_kernels/nbnxn_kernel_ref.c
+++ b/
src/gromacs/mdlib/nbnxn_kernels/nbnxn_kernel_ref.c
@@
-185,6
+185,7
@@
nbnxn_kernel_ref(const nbnxn_pairlist_set_t *nbl_list,
int coult;
int vdwt;
int nb;
int coult;
int vdwt;
int nb;
+ int nthreads gmx_unused;
nnbl = nbl_list->nnbl;
nbl = nbl_list->nbl;
nnbl = nbl_list->nnbl;
nbl = nbl_list->nbl;
@@
-242,7
+243,8
@@
nbnxn_kernel_ref(const nbnxn_pairlist_set_t *nbl_list,
gmx_incons("Unsupported vdwtype in nbnxn reference kernel");
}
gmx_incons("Unsupported vdwtype in nbnxn reference kernel");
}
-#pragma omp parallel for schedule(static) num_threads(gmx_omp_nthreads_get(emntNonbonded))
+ nthreads = gmx_omp_nthreads_get(emntNonbonded);
+#pragma omp parallel for schedule(static) num_threads(nthreads)
for (nb = 0; nb < nnbl; nb++)
{
nbnxn_atomdata_output_t *out;
for (nb = 0; nb < nnbl; nb++)
{
nbnxn_atomdata_output_t *out;