X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-M%2Finclude_unres%2FCOMMON.LOCAL;h=a248d99294c73f052d2ec89b41c6b3fa9a567d93;hb=90a47ba2f9ea5c266c59b225f8505a81d75420d7;hp=42ace376b6d5cb11fbcf7e4df48e4e9f98a79899;hpb=3509d76c6e5552809caea3484f5889a2e51a011a;p=unres.git diff --git a/source/wham/src-M/include_unres/COMMON.LOCAL b/source/wham/src-M/include_unres/COMMON.LOCAL index 42ace37..a248d99 100644 --- a/source/wham/src-M/include_unres/COMMON.LOCAL +++ b/source/wham/src-M/include_unres/COMMON.LOCAL @@ -2,7 +2,7 @@ & sigc0,dsc,dsc_inv,bsc,censc,gaussc,dsc0,vbl,vblinv,vblinv2, & vbl_cis,vbl0,vbld_inv integer nlob,loc_start,loc_end,ithet_start,ithet_end, - & iphi_start,iphi_end + & iphi_start,iphi_end,itau_start,itau_end C Parameters of the virtual-bond-angle probability distribution common /thetas/ a0thet(ntyp),athet(2,ntyp),bthet(2,ntyp), & polthet(0:3,ntyp),gthet(3,ntyp),theta0(ntyp),sig0(ntyp), @@ -29,17 +29,8 @@ C Parameters of the side-chain probability distribution & censc(3,maxlob,ntyp),gaussc(3,3,maxlob,ntyp),dsc0(ntyp1), & nlob(ntyp1) C Virtual-bond lenghts - double precision vbl,vblinv,vblinv2,vbl_cis,vbl0,vbld_inv - integer loc_start,loc_end,ithet_start,ithet_end,iphi_start, - & iphi_end,iphid_start,iphid_end,ibond_start,ibond_end, - & ibondp_start,ibondp_end,ivec_start,ivec_end,iset_start,iset_end, - & iturn3_start,iturn3_end,iturn4_start,iturn4_end,iint_start, - & iint_end,iphi1_start,iphi1_end,itau_start,itau_end common /peptbond/ vbl,vblinv,vblinv2,vbl_cis,vbl0 common /indices/ loc_start,loc_end,ithet_start,ithet_end, - & iphi_start,iphi_end,iphid_start,iphid_end,ibond_start,ibond_end, - & ibondp_start,ibondp_end,ivec_start,ivec_end,iset_start,iset_end, - & iturn3_start,iturn3_end,iturn4_start,iturn4_end,iint_start, - & iint_end,iphi1_start,iphi1_end,itau_start,itau_end + & iphi_start,iphi_end,itau_start,itau_end C Inverses of the actual virtual bond lengths common /invlen/ vbld_inv(maxres2)