From: Pawel Krupa <pk376@matrix.chem.cornell.edu>
Date: Sun, 15 May 2016 20:00:46 +0000 (-0400)
Subject: Cluster-M structure and maximum residue changes.
X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=commitdiff_plain;h=a18dddf359359ae113283afa0c92a06bcb430a7b

Cluster-M structure and maximum residue changes.
---

diff --git a/source/cluster/wham/src-M/DIMENSIONS b/source/cluster/wham/src-M/DIMENSIONS
index 1bcdf79..ae11439 100644
--- a/source/cluster/wham/src-M/DIMENSIONS
+++ b/source/cluster/wham/src-M/DIMENSIONS
@@ -6,10 +6,10 @@
 ********************************************************************************
 C Max. number of processors.
       integer maxprocs
-      parameter (maxprocs=16)
+      parameter (maxprocs=24)
 C Max. number of AA residues
       integer maxres,maxres2
-      parameter (maxres=650)
+      parameter (maxres=1150)
 C Appr. max. number of interaction sites
       parameter (maxres2=2*maxres)
 C Max. number of variables
diff --git a/source/cluster/wham/src-M/sizesclu.dat b/source/cluster/wham/src-M/sizesclu.dat
index 1810f0c..30ac675 100644
--- a/source/cluster/wham/src-M/sizesclu.dat
+++ b/source/cluster/wham/src-M/sizesclu.dat
@@ -5,8 +5,8 @@
 * Max. number of conformations in the data set.
 *
       integer maxconf,maxstr_proc
-      PARAMETER (MAXCONF=13000)
-      parameter (maxstr_proc=maxconf/2)
+      PARAMETER (MAXCONF=7500)
+      parameter (maxstr_proc=maxconf/4)
 *
 * Max. number of "distances" between conformations.
 *