5a00bb23389f4c2b78adf68e888723cf14b1201b
[unres.git] / source / wham / src / include_unres / COMMON.LOCAL
1       double precision a0thet,athet,bthet,polthet,gthet,theta0,sig0,
2      & sigc0,dsc,dsc_inv,bsc,censc,gaussc,dsc0,vbl,vblinv,vblinv2,
3      & vbl_cis,vbl0,vbld_inv
4       integer nlob,loc_start,loc_end,ithet_start,ithet_end,
5      & iphi_start,iphi_end,itau_start,itau_end
6 C Parameters of the virtual-bond-angle probability distribution
7       common /thetas/ a0thet(-ntyp:ntyp),athet(2,-ntyp:ntyp,-1:1,-1:1)
8      &  ,bthet(2,-ntyp:ntyp,-1:1,-1:1),
9      &  polthet(0:3,-ntyp:ntyp),gthet(3,-ntyp:ntyp),theta0(-ntyp:ntyp),
10      &sig0(-ntyp:ntyp),  sigc0(-ntyp:ntyp)
11 C Parameters of ab initio-derived potential of virtual-bond-angle bending
12       integer nthetyp,ntheterm,ntheterm2,ntheterm3,nsingle,ndouble,
13      & ithetyp(ntyp1),nntheterm
14       double precision aa0thet(maxthetyp1,maxthetyp1,maxthetyp1),
15      & aathet(maxtheterm,maxthetyp1,maxthetyp1,maxthetyp1),
16      & bbthet(maxsingle,maxtheterm2,maxthetyp1,maxthetyp1,maxthetyp1),
17      & ccthet(maxsingle,maxtheterm2,maxthetyp1,maxthetyp1,maxthetyp1),
18      & ddthet(maxsingle,maxtheterm2,maxthetyp1,maxthetyp1,maxthetyp1),
19      & eethet(maxsingle,maxtheterm2,maxthetyp1,maxthetyp1,maxthetyp1),
20      & ffthet(maxdouble,maxdouble,maxtheterm3,maxthetyp1,maxthetyp1,
21      &  maxthetyp1),
22      & ggthet(maxdouble,maxdouble,maxtheterm3,maxthetyp1,maxthetyp1,
23      &  maxthetyp1)
24       common /theta_abinitio/aa0thet,aathet,bbthet,ccthet,ddthet,eethet,
25      &  ffthet,
26      &  ggthet,ithetyp,nthetyp,ntheterm,ntheterm2,ntheterm3,nsingle,
27      &  ndouble,nntheterm
28 C Parameters of the side-chain probability distribution
29       common /sclocal/ dsc(ntyp1),dsc_inv(ntyp1),bsc(maxlob,ntyp),
30      &  censc(3,maxlob,-ntyp:ntyp),gaussc(3,3,maxlob,-ntyp:ntyp),
31      &    dsc0(ntyp1),
32      &    nlob(ntyp1)
33 C Virtual-bond lenghts
34       common /peptbond/ vbl,vblinv,vblinv2,vbl_cis,vbl0
35       common /indices/ loc_start,loc_end,ithet_start,ithet_end,
36      &                 iphi_start,iphi_end,itau_start,itau_end
37 C Inverses of the actual virtual bond lengths
38       common /invlen/ vbld_inv(maxres2)