X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-M%2FDIMENSIONS.ZSCOPT;h=7f31d7ff4c0979a3999e5c79a5c2d25101ed42f7;hb=34d3ad3987785642be58fb2f26557d3314215577;hp=2f5ee7692c4736dccd63a59a7ddf1973d840868b;hpb=f690e8b70bab14132839afebf080d4a28363b226;p=unres.git diff --git a/source/wham/src-M/DIMENSIONS.ZSCOPT b/source/wham/src-M/DIMENSIONS.ZSCOPT index 2f5ee76..7f31d7f 100644 --- a/source/wham/src-M/DIMENSIONS.ZSCOPT +++ b/source/wham/src-M/DIMENSIONS.ZSCOPT @@ -3,10 +3,10 @@ c Maximum number of structures in the database, energy components, proteins, c and structural classes c#ifdef JUBL - parameter (maxstr=200000,max_ene=21,maxprot=7,maxclass=5000) + parameter (maxstr=200000,max_ene=25,maxprot=7,maxclass=10) parameter (maxclass1=10) c Maximum number of structures to be dealt with by one processor - parameter (maxstr_proc=10000) + parameter (maxstr_proc=20000) c Maximum number of temperatures integer maxT parameter (maxT=10) @@ -25,7 +25,7 @@ c Maximum number of grid points in energy map evaluation parameter (max_x=200,max_y=200,max_minim=1000) c Maximum number of processors integer MaxProcs - parameter (MaxProcs = 2048) + parameter (MaxProcs = 128) c Maximum number of optimizable parameters integer max_paropt parameter (max_paropt=500)