X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc_MD-M%2FCOMMON.CHAIN;h=372fa85b9f9986351f671a10ea9e25ef189cb793;hb=14b55af23c7da34bfdc10f315551c8e01a3a906a;hp=914c40268ec818f74324e63034fa7cadabcb1713;hpb=f038962fbb96e0c2c6f1ccb910373ceddd5b387b;p=unres.git diff --git a/source/unres/src_MD-M/COMMON.CHAIN b/source/unres/src_MD-M/COMMON.CHAIN index 914c402..372fa85 100644 --- a/source/unres/src_MD-M/COMMON.CHAIN +++ b/source/unres/src_MD-M/COMMON.CHAIN @@ -2,7 +2,8 @@ & 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,velAFMconst + & prod,rt,dc_work,cref,crefjlee,chain_rep,dc_norm2,velAFMconst, + & totTafm 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), @@ -17,8 +18,14 @@ common /from_zscore/ nz_start,nz_end,iz_sc double precision boxxsize,boxysize,boxzsize,enecut,sscut, & sss,sssgrad, - & buflipbot, bufliptop,bordlipbot,bordliptop,lipbufthick,lipthick + & buflipbot, bufliptop,bordlipbot,bordliptop,lipbufthick,lipthick, + & tubecenter,tubeR0, + & buftubebot, buftubetop,bordtubebot,bordtubetop,tubebufthick common /box/ boxxsize,boxysize,boxzsize,enecut,sscut,sss,sssgrad, & buflipbot, bufliptop,bordlipbot,bordliptop,lipbufthick,lipthick - common /afm/ forceAFMconst, distafminit,afmend,afmbeg,velAFMconst + common /afm/ forceAFMconst, distafminit,afmend,afmbeg, + & velAFMconst, + & totTafm + common /tube/ tubecenter(3),tubeR0, + & buftubebot, buftubetop,bordtubebot,bordtubetop,tubebufthick