Merge release-4-6 into master

[alexxy/gromacs.git] / src / gromacs / gmxlib / txtdump.c

diff --git a/src/gromacs/gmxlib/txtdump.c b/src/gromacs/gmxlib/txtdump.c
index 2f4218c6641586a0014e5f149fc9f3e17116f214..82922dce52124ae79373b0906038ac4ed2817d58 100644 (file)
--- a/src/gromacs/gmxlib/txtdump.c
+++ b/src/gromacs/gmxlib/txtdump.c
@@ -562,6 +562,20 @@ static void pr_fepvals(FILE *fp,int indent,t_lambda *fep, gmx_bool bMDPformat)
     if (fep->n_lambda > 0)
     {
         pr_indent(fp,indent);
+        fprintf(fp,"separate-dvdl%s\n",bMDPformat ? " = " : ":");
+        for(i=0; i<efptNR; i++)
+        {
+            fprintf(fp,"%18s = ",efpt_names[i]);
+            if (fep->separate_dvdl[i])
+            {
+                fprintf(fp,"  TRUE");
+            }
+            else
+            {
+                fprintf(fp,"  FALSE");
+            }
+            fprintf(fp,"\n");
+        }
         fprintf(fp,"all-lambdas%s\n",bMDPformat ? " = " : ":");
         for(i=0; i<efptNR; i++) {
             fprintf(fp,"%18s = ",efpt_names[i]);
@@ -572,6 +586,7 @@ static void pr_fepvals(FILE *fp,int indent,t_lambda *fep, gmx_bool bMDPformat)
             fprintf(fp,"\n");
         }
     }
+    PI("calc-lambda-neighbors",fep->lambda_neighbors);
 
     PR("sc-alpha",fep->sc_alpha);
     PS("bScCoul",EBOOL(fep->bScCoul));