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Fixed pbc=xy + 2 walls + Verlet scheme
[alexxy/gromacs.git]
/
src
/
gromacs
/
mdlib
/
domdec.c
diff --git
a/src/gromacs/mdlib/domdec.c
b/src/gromacs/mdlib/domdec.c
index ce88e2e3809aa2c32c208d2be1805fef4f1a97c7..2ebc52e545d9c54ad41c3fbf86bf78c76d1e40fb 100644
(file)
--- a/
src/gromacs/mdlib/domdec.c
+++ b/
src/gromacs/mdlib/domdec.c
@@
-8718,7
+8718,7
@@
static void set_zones_size(gmx_domdec_t *dd,
/* To determine the bounding box for a zone we need to find
* the extreme corners of 4, 2 or 1 corners.
*/
- nc = 1 << (ddbox->n
pbc
dim - 1);
+ nc = 1 << (ddbox->n
bounded
dim - 1);
for (c = 0; c < nc; c++)
{