Merge release-5-0 into master

[alexxy/gromacs.git] / src / gromacs / mdlib / nbnxn_search.c

diff --git a/src/gromacs/mdlib/nbnxn_search.c b/src/gromacs/mdlib/nbnxn_search.c
index 3eea183950baeaaeae3b8630f537c2bd7350b1fe..0ee8b4d4d09303d14c4b06c927caf3ddc9227749 100644 (file)
--- a/src/gromacs/mdlib/nbnxn_search.c
+++ b/src/gromacs/mdlib/nbnxn_search.c
@@ -1693,8 +1693,8 @@ static void calc_cell_indices(const nbnxn_search_t nbs,
     }
 
     /* Sort the super-cell columns along z into the sub-cells. */
-#pragma omp parallel for num_threads(nbs->nthread_max) schedule(static)
-    for (thread = 0; thread < nbs->nthread_max; thread++)
+#pragma omp parallel for num_threads(nthread) schedule(static)
+    for (thread = 0; thread < nthread; thread++)
     {
         if (grid->bSimple)
         {