Merge release-4-6 into master

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

diff --git a/src/gromacs/mdlib/md_support.c b/src/gromacs/mdlib/md_support.c
index b3b7b6ab32b514eebdbff2e0767dfe041e22c566..7b32baab22541a6d02743b87fe8bff26882935f2 100644 (file)
--- a/src/gromacs/mdlib/md_support.c
+++ b/src/gromacs/mdlib/md_support.c
@@ -490,9 +490,6 @@ void compute_globals(FILE *fplog, gmx_global_stat_t gstat, t_commrec *cr, t_inpu
         enerd->term[F_PDISPCORR] = prescorr;
         enerd->term[F_PRES] += prescorr;
         *pcurr = enerd->term[F_PRES];
-        /* calculate temperature using virial */
-        enerd->term[F_VTEMP] = calc_temp(trace(total_vir),ir->opts.nrdf[0]);
-
     }    
 }