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Print in higher precision repl_ex timestep.
author
Rossen Apostolov
<rossen@kth.se>
Tue, 10 Jun 2014 13:44:36 +0000
(15:44 +0200)
committer
Rossen Apostolov
<rossen@kth.se>
Tue, 10 Jun 2014 13:44:36 +0000
(15:44 +0200)
Fixes #1486.
Change-Id: Ibe5bcee18f761bea96e1b4a432774a4472a40f47
src/kernel/repl_ex.c
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diff --git
a/src/kernel/repl_ex.c
b/src/kernel/repl_ex.c
index 3bbb3f94ef4b0304e48cc62c7960ac130487625a..1636b38f18a152e5348c710bd3dc8897afb419e3 100644
(file)
--- a/
src/kernel/repl_ex.c
+++ b/
src/kernel/repl_ex.c
@@
-904,7
+904,7
@@
test_for_replica_exchange(FILE *fplog,
gmx_bool bVol = FALSE;
bMultiEx = (re->nex > 1); /* multiple exchanges at each state */
- fprintf(fplog, "Replica exchange at step " gmx_large_int_pfmt " time %
g
\n", step, time);
+ fprintf(fplog, "Replica exchange at step " gmx_large_int_pfmt " time %
.15e
\n", step, time);
if (re->bNPT)
{