biod.pnpi.spb.ru
/
alexxy
/
gromacs.git
/ blobdiff
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
shortlog
|
log
|
commit
|
commitdiff
|
tree
raw
| inline |
side by side
Fixed bug in parallel v/f constraining
[alexxy/gromacs.git]
/
src
/
mdlib
/
constr.c
diff --git
a/src/mdlib/constr.c
b/src/mdlib/constr.c
index 0e1a6ee524089e1867cc68db7995b81821178c11..a5e1754373791c8cc0709023446f2c2ddef2659b 100644
(file)
--- a/
src/mdlib/constr.c
+++ b/
src/mdlib/constr.c
@@
-415,7
+415,7
@@
gmx_bool constrain(FILE *fplog, gmx_bool bLog, gmx_bool bEner,
*/
if (cr->dd)
{
- dd_move_x_constraints(cr->dd, box, x, xprime);
+ dd_move_x_constraints(cr->dd, box, x, xprime
, econq == econqCoord
);
}
else if (PARTDECOMP(cr))
{