X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-M%2FDIMENSIONS;h=2fe913cb82a5adc5c4158e82edef8fc7e9f94078;hb=058b4e72d61c149f66570d580bda9b47464d9df6;hp=dcb64c3968ba84d7accf1042c468a13b977aa4ed;hpb=7006db11d703450fb82ce20cfc53f74614334362;p=unres.git diff --git a/source/wham/src-M/DIMENSIONS b/source/wham/src-M/DIMENSIONS index dcb64c3..2fe913c 100644 --- a/source/wham/src-M/DIMENSIONS +++ b/source/wham/src-M/DIMENSIONS @@ -14,7 +14,7 @@ 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) @@ -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) @@ -146,3 +146,6 @@ C Maximum number of terms in SC bond-stretching potential C Maximum number of templates in homology-modeling restraints integer max_template parameter(max_template=25) +C Maximum number of bins in SAXS restraints + integer MaxSAXS + parameter (MaxSAXS=1000)