X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc-HCD-5D%2FCOMMON.CHAIN;h=da83764006ea58d98cf626e8f408d8d9bd30db3f;hb=b2a27cc1df35ba97ad9dc3929c492ffc87cfbcf3;hp=c394c5e3958d3441851cd99da53311bfba2a24a0;hpb=020e579626d686ec20ecd9f0cc4c8313f474e152;p=unres.git diff --git a/source/unres/src-HCD-5D/COMMON.CHAIN b/source/unres/src-HCD-5D/COMMON.CHAIN index c394c5e..da83764 100644 --- a/source/unres/src-HCD-5D/COMMON.CHAIN +++ b/source/unres/src-HCD-5D/COMMON.CHAIN @@ -1,9 +1,11 @@ integer nres,nsup,nstart_sup,nz_start,nz_end,iz_sc, & nres0,nstart_seq,nchain,chain_length,chain_border,iprzes, - & ireschain,tabpermchain,npermchain,afmend,afmbeg + & chain_border1,ireschain,tabpermchain,npermchain,afmend,afmbeg, + & nres_chomo,nmodel_start double precision c,dc,dc_old,d_c_work,xloc,xrot,dc_norm,t,r, & prod,rt,dc_work,cref,crefjlee,dc_norm2,velAFMconst, & totTafm,chomo + character*256 pdbfiles_chomo(max_template) common /chain/ c(3,maxres2+2),dc(3,0:maxres2),dc_old(3,0:maxres2), & xloc(3,maxres),xrot(3,maxres),dc_norm(3,0:maxres2), & dc_norm2(3,0:maxres2), @@ -15,7 +17,7 @@ & nsup,nstart_sup,nstart_seq,iprzes, & chain_length(maxchain),npermchain,ireschain(maxres), & tabpermchain(maxchain,maxperm), - & chain_border(2,maxchain),nchain + & chain_border(2,maxchain),chain_border1(2,maxchain),nchain common /from_zscore/ nz_start,nz_end,iz_sc double precision boxxsize,boxysize,boxzsize,enecut,sscut, & sss,sssgrad, @@ -30,4 +32,6 @@ & totTafm common /tube/ tubecenter(3),tubeR0, & buftubebot, buftubetop,bordtubebot,bordtubetop,tubebufthick - common /chomo_models/ chomo(3,maxres2+2,max_template) + common /chomo_models/ chomo(3,maxres2+2,max_template), + & nres_chomo(max_template),nmodel_start + common /chomo_files/ pdbfiles_chomo