dfa idfamax 15000
authorCezary Czaplewski <czarek@chem.univ.gda.pl>
Tue, 16 Jun 2020 11:56:16 +0000 (13:56 +0200)
committerCezary Czaplewski <czarek@chem.univ.gda.pl>
Tue, 16 Jun 2020 11:56:16 +0000 (13:56 +0200)
source/cluster/wham/src-HCD-5D/COMMON.DFA
source/unres/src-HCD-5D/COMMON.DFA
source/wham/src-HCD-5D/COMMON.DFA

index 064a7ce..08f6b0c 100644 (file)
@@ -11,7 +11,7 @@ C Total : ~ 11 * Nres restraints
 C
 C
       INTEGER IDFAMAX,IDFAMX2,IDFACMD,IDMAXMIN, MAXN
-      PARAMETER(IDFAMAX=10000,IDFAMX2=1000,IDFACMD=500,IDMAXMIN=500)
+      PARAMETER(IDFAMAX=15000,IDFAMX2=1000,IDFACMD=500,IDMAXMIN=500)
       PARAMETER(MAXN=4)
       real*8 wwdist,wwangle,wwnei
       parameter(wwdist=1.0d0,wwangle=1.0d0,wwnei=1.0d0)
index 6759f8b..662b7d7 100644 (file)
@@ -11,7 +11,7 @@ C Total : ~ 11 * Nres restraints
 C
 C
       INTEGER IDFAMAX,IDFAMX2,IDFACMD,IDMAXMIN, MAXN
-      PARAMETER(IDFAMAX=4000,IDFAMX2=1000,IDFACMD=500,IDMAXMIN=500)
+      PARAMETER(IDFAMAX=15000,IDFAMX2=1000,IDFACMD=500,IDMAXMIN=500)
       PARAMETER(MAXN=4)
       real*8 wwdist,wwangle,wwnei
       parameter(wwdist=1.0d0,wwangle=1.0d0,wwnei=1.0d0)
index 064a7ce..08f6b0c 100644 (file)
@@ -11,7 +11,7 @@ C Total : ~ 11 * Nres restraints
 C
 C
       INTEGER IDFAMAX,IDFAMX2,IDFACMD,IDMAXMIN, MAXN
-      PARAMETER(IDFAMAX=10000,IDFAMX2=1000,IDFACMD=500,IDMAXMIN=500)
+      PARAMETER(IDFAMAX=15000,IDFAMX2=1000,IDFACMD=500,IDMAXMIN=500)
       PARAMETER(MAXN=4)
       real*8 wwdist,wwangle,wwnei
       parameter(wwdist=1.0d0,wwangle=1.0d0,wwnei=1.0d0)