X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-HCD%2FCOMMON.CHAIN;h=7b79a58c6b4157e8f32356617f6b8b5fdb63e05e;hb=32caa3b64eb94b90fa9fd402b77263ea89efffa1;hp=7369baa1624373baf60c5f21aa472b834e22be19;hpb=1346fb3959c2eb0a370b11bc6ccad5e4cca27ec9;p=unres.git diff --git a/source/wham/src-HCD/COMMON.CHAIN b/source/wham/src-HCD/COMMON.CHAIN index 7369baa..7b79a58 100644 --- a/source/wham/src-HCD/COMMON.CHAIN +++ b/source/wham/src-HCD/COMMON.CHAIN @@ -1,6 +1,6 @@ integer nres,nres0,nsup,nstart_sup,nend_sup,nstart_seq, - & ishift_pdb,chain_length,chain_border,ichanres,tabpermchain, - & nchain ,npermchain,ireschain,iz_sc + & ishift_pdb,chain_length,chain_border,chain_border1,ichanres, + & tabpermchain,nchain ,npermchain,ireschain,iz_sc,nres_chomo double precision c,cref,crefjlee,dc,xloc,xrot,dc_norm,t,r,prod,rt, & rmssing,anatemp,chomo common /chain/ c(3,maxres2+2),dc(3,maxres2),xloc(3,maxres), @@ -11,10 +11,12 @@ & rmssing,anatemp,iz_sc,nsup, & nstart_sup,nend_sup,chain_length(maxchain),npermchain, & ireschain(maxres),tabpermchain(maxchain,maxperm), - & chain_border(2,maxchain),nchain,nstart_seq,ishift_pdb + & chain_border(2,maxchain),chain_border1(2,maxchain),nchain, + & nstart_seq,ishift_pdb double precision boxxsize,boxysize,boxzsize,enecut,sscut,sss, & sssgrad, & buflipbot, bufliptop,bordlipbot,bordliptop,lipbufthick,lipthick common /box/ boxxsize,boxysize,boxzsize,enecut,sscut,sss,sssgrad, & buflipbot, bufliptop,bordlipbot,bordliptop,lipbufthick,lipthick - common /chomo_models/ chomo(3,maxres2+2,max_template) + common /chomo_models/ chomo(3,maxres2+2,max_template), + & nres_chomo(max_template)