X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fcluster%2Fwham%2Fsrc%2FDIMENSIONS;h=211ffe3a4901c2fe06034dd72f90717d9e484af4;hb=fe57f0b74ce7dbc219e0ed656b7bc720e729b001;hp=03af0c63d104c07620eeddde9fb416ed10d7b378;hpb=5c761729cbbd03c462d7b202afd8a9c3d7baebbd;p=unres.git diff --git a/source/cluster/wham/src/DIMENSIONS b/source/cluster/wham/src/DIMENSIONS index 03af0c6..211ffe3 100644 --- a/source/cluster/wham/src/DIMENSIONS +++ b/source/cluster/wham/src/DIMENSIONS @@ -9,7 +9,7 @@ C Max. number of processors. parameter (maxprocs=16) C Max. number of AA residues integer maxres,maxres2 - parameter (maxres=350) + parameter (maxres=800) C Appr. max. number of interaction sites parameter (maxres2=2*maxres) C Max. number of variables @@ -67,4 +67,7 @@ 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 clusters of templates containing same fragments + integer maxclust + parameter(maxclust=1000)