X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc_MD-M%2FCOMMON.CHAIN;h=fe0297c26143edf60917b18ea0f6ab9d756a2f12;hb=84bd5165b1f28ca095851e740cbcc1ff2a6be29c;hp=f3438874df594e87f554252e7e2bf5ceac3408dd;hpb=7675ab8ec26554f2fd3f2e7e427b177254872a45;p=unres.git diff --git a/source/unres/src_MD-M/COMMON.CHAIN b/source/unres/src_MD-M/COMMON.CHAIN index f343887..fe0297c 100644 --- a/source/unres/src_MD-M/COMMON.CHAIN +++ b/source/unres/src_MD-M/COMMON.CHAIN @@ -1,5 +1,6 @@ integer nres,nsup,nstart_sup,nz_start,nz_end,iz_sc, - & nres0,nstart_seq,chain_length,iprzes,tabperm,nperm + & nres0,nstart_seq,chain_length,iprzes,tabperm,nperm,afmend, + & afmbeg double precision c,dc,dc_old,d_c_work,xloc,xrot,dc_norm,t,r, & prod,rt,dc_work,cref,crefjlee,chain_rep,dc_norm2 common /chain/ c(3,maxres2+2),dc(3,0:maxres2),dc_old(3,0:maxres2), @@ -14,3 +15,10 @@ & nsup,nstart_sup,nstart_seq, & chain_length,iprzes,tabperm(maxperm,maxsym),nperm common /from_zscore/ nz_start,nz_end,iz_sc + 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 /afm/ forceAFMconst, distafminit,afmend,afmbeg +