src-M max_template=50

[unres.git] / source / wham / src-M / DIMENSIONS

diff --git a/source/wham/src-M/DIMENSIONS b/source/wham/src-M/DIMENSIONS
index dcb64c3..e07f6dc 100644 (file)
--- a/source/wham/src-M/DIMENSIONS
+++ b/source/wham/src-M/DIMENSIONS
@@ -14,13 +14,13 @@ c      parameter (max_cg_procs=maxprocs)
 C Max. number of AA residues
       integer maxres
 c      parameter (maxres=250)
-      parameter (maxres=800)
+      parameter (maxres=1000)
 C Appr. max. number of interaction sites
       integer maxres2
       parameter (maxres2=2*maxres)
 C Max number of symetries
        integer maxsym,maxperm
-       parameter (maxsym=5,maxperm=120)
+       parameter (maxsym=15,maxperm=120)
 C Max. number of variables
       integer maxvar
       parameter (maxvar=4*maxres)
@@ -61,7 +61,7 @@ C Max. number of lobes in SC distribution
       parameter (maxlob=4)
 C Max. number of S-S bridges
       integer maxss
-      parameter (maxss=20)
+      parameter (maxss=60)
 C Max. number of dihedral angle constraints
       integer maxdih_constr
       parameter (maxdih_constr=maxres)
@@ -145,4 +145,11 @@ C Maximum number of terms in SC bond-stretching potential
       parameter (maxbondterm=3)
 C Maximum number of templates in homology-modeling restraints
       integer max_template
-      parameter(max_template=25)
+      parameter(max_template=50)
+C Maximum number of bins in SAXS restraints
+      integer MaxSAXS
+      parameter (MaxSAXS=1000)
+c Maximum number of clusters of templates containing same fragments
+      integer maxclust
+      parameter(maxclust=1000)
+