X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc-HCD-5D%2FCOMMON.SBRIDGE;h=a71e1de2923790f6ca281869686412b362b1bb8f;hb=1441ec2b7d68b4fd94014649e4bd9574db0bfc36;hp=e5f9a334bcf3b9e95739fbed2fc62c5de6cdf7a1;hpb=79fd686e9d9aaa23e4fda802ee16379470e961d3;p=unres.git diff --git a/source/unres/src-HCD-5D/COMMON.SBRIDGE b/source/unres/src-HCD-5D/COMMON.SBRIDGE index e5f9a33..a71e1de 100644 --- a/source/unres/src-HCD-5D/COMMON.SBRIDGE +++ b/source/unres/src-HCD-5D/COMMON.SBRIDGE @@ -1,21 +1,23 @@ double precision ss_depth,ebr,d0cm,akcm,akth,akct,v1ss,v2ss,v3ss - integer ns,nss,nfree,iss + integer ns,nss,nfree,iss,icys common /sbridge/ ss_depth,ebr,d0cm,akcm,akth,akct,v1ss,v2ss,v3ss, - & ns,nss,nfree,iss(maxss) + & ns,nss,nfree,iss(max_cyst),icys(maxres) double precision dhpb,dhpb1,forcon,fordepth,xlscore,wboltzd, & dhpb_peak,dhpb1_peak,forcon_peak,fordepth_peak,scal_peak,bfac integer ihpb,jhpb,nhpb,idssb,jdssb,ibecarb,ibecarb_peak,npeak, & ipeak, & irestr_type,irestr_type_peak,ihpb_peak,jhpb_peak,nhpb_peak logical restr_on_coord - common /links/ dhpb(maxdim),dhpb1(maxdim),forcon(maxdim), - & fordepth(maxdim),bfac(maxres),xlscore(maxdim),wboltzd, - & ihpb(maxdim),jhpb(maxdim),ibecarb(maxdim),irestr_type(maxdim), - & nhpb,restr_on_coord - common /NMRpeaks/ dhpb_peak(maxdim),dhpb1_peak(maxdim), - & forcon_peak(maxdim),fordepth_peak(maxdim),scal_peak, - & ihpb_peak(maxdim),jhpb_peak(maxdim),ibecarb_peak(maxdim), - & irestr_type_peak(maxdim),ipeak(2,maxdim),npeak,nhpb_peak + common /links/ dhpb(maxdim_cont),dhpb1(maxdim_cont), + & forcon(maxdim_cont),fordepth(maxdim_cont),bfac(maxres), + & xlscore(maxdim_cont),wboltzd, + & ihpb(maxdim_cont),jhpb(maxdim_cont),ibecarb(maxdim_cont), + & irestr_type(maxdim_cont),nhpb,restr_on_coord + common /NMRpeaks/ dhpb_peak(maxdim_cont),dhpb1_peak(maxdim_cont), + & forcon_peak(maxdim_cont),fordepth_peak(maxdim_cont),scal_peak, + & ihpb_peak(maxdim_cont),jhpb_peak(maxdim_cont), + & ibecarb_peak(maxdim_cont),irestr_type_peak(maxdim_cont), + & ipeak(2,maxdim_cont),npeak,nhpb_peak double precision weidis common /restraints/ weidis integer link_start,link_end,link_start_peak,link_end_peak @@ -23,6 +25,6 @@ & link_end_peak double precision Ht,dyn_ssbond_ij,dtriss,atriss,btriss,ctriss logical dyn_ss,dyn_ss_mask - common /dyn_ssbond/ dyn_ssbond_ij(maxres,maxres), + common /dyn_ssbond/ dyn_ssbond_ij(max_cyst,max_cyst), & Ht,dtriss,atriss,btriss,ctriss,dyn_ss,dyn_ss_mask(maxres), - & idssb(maxdim),jdssb(maxdim) + & idssb(maxss),jdssb(maxss)