added Verlet scheme and NxN non-bonded functionality

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

diff --git a/src/mdlib/ns.c b/src/mdlib/ns.c
index 2757cbd2dde292bd7f83a2d209ff1c233ed49989..571e7047c78ebb574d99daf8e671a13628e9bc91 100644 (file)
--- a/src/mdlib/ns.c
+++ b/src/mdlib/ns.c
@@ -2585,7 +2585,7 @@ int search_neighbours(FILE *log,t_forcerec *fr,
         {
             dd_zones = NULL;
 
-            get_nsgrid_boundaries(grid,NULL,box,NULL,NULL,NULL,
+            get_nsgrid_boundaries(grid->nboundeddim,box,NULL,NULL,NULL,NULL,
                                   cgs->nr,fr->cg_cm,grid_x0,grid_x1,&grid_dens);
 
             grid_first(log,grid,NULL,NULL,fr->ePBC,box,grid_x0,grid_x1,