From: Carsten Kutzner <ckutzne@gwdg.de>
Date: Thu, 20 Dec 2012 12:20:28 +0000 (+0100)
Subject: Small fix for g_tune_pme
X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=commitdiff_plain;h=77b5db00d0602e0e6c4b84b8cac3963f180c432e;p=alexxy%2Fgromacs.git

Small fix for g_tune_pme

Setting the "-err" command line flag in g_tune_pme would, in combination with the "-launch" flag
prevent a proper launch of mdrun after tuning since "-err" would also appear on the mdrun
command line. This patch removes the "-err" switch from the mdrun arguments list.

Change-Id: Idb2e3cf2e4eca587180b932faccc227be171b3d7
---

diff --git a/src/tools/gmx_tune_pme.c b/src/tools/gmx_tune_pme.c
index 574a85bc56..4995d9ca26 100644
--- a/src/tools/gmx_tune_pme.c
+++ b/src/tools/gmx_tune_pme.c
@@ -1567,15 +1567,14 @@ static void check_input(
 /* Returns TRUE when "opt" is needed at launch time */
 static gmx_bool is_launch_file(char *opt, gmx_bool bSet)
 {
-    /* Apart from the input .tpr we need all options that were set
+    /* Apart from the input .tpr and the error log we need all options that were set
      * on the command line and that do not start with -b */
-    if (0 == strncmp(opt,"-b", 2) || 0 == strncmp(opt,"-s", 2))
+    if (0 == strncmp(opt,"-b", 2) || 0 == strncmp(opt,"-s", 2) || 0 == strncmp(opt,"-err", 4))
+    {
         return FALSE;
+    }
 
-    if (bSet)
-        return TRUE;
-    else
-        return FALSE;
+    return bSet;
 }