Fixed the "***" issue in PDB output format by shifting the center of each molecule...
[unres.git] / source / wham / src / COMMON.ALLPARM
1       double precision ww_all(max_ene,max_parm),
2      & vbldp0_all(max_parm),akp_all(max_parm),
3      & vbldsc0_all(maxbondterm,ntyp,max_parm),
4      & aksc_all(maxbondterm,ntyp,max_parm),
5      & abond0_all(maxbondterm,ntyp,max_parm),
6      & a0thet_all(ntyp,max_parm),athet_all(2,ntyp,max_parm),
7      & bthet_all(2,ntyp,max_parm),polthet_all(0:3,ntyp,max_parm),
8      & gthet_all(3,ntyp,max_parm),theta0_all(ntyp,max_parm),
9      & sig0_all(ntyp,max_parm),sigc0_all(ntyp,max_parm),
10      & aa0thet_all(maxthetyp1,maxthetyp1,maxthetyp1,max_parm),
11      & aathet_all(maxtheterm,maxthetyp1,maxthetyp1,maxthetyp1,max_parm),
12      & bbthet_all(maxsingle,maxtheterm2,maxthetyp1,maxthetyp1,
13      & maxthetyp1,max_parm),
14      & ccthet_all(maxsingle,maxtheterm2,maxthetyp1,maxthetyp1,
15      & maxthetyp1,max_parm),
16      & ddthet_all(maxsingle,maxtheterm2,maxthetyp1,maxthetyp1,
17      & maxthetyp1,max_parm),
18      & eethet_all(maxsingle,maxtheterm2,maxthetyp1,maxthetyp1,
19      & maxthetyp1,max_parm),
20      & ffthet_all(maxdouble,maxdouble,maxtheterm3,maxthetyp1,maxthetyp1,
21      &  maxthetyp1,max_parm),
22      & ggthet_all(maxdouble,maxdouble,maxtheterm3,maxthetyp1,maxthetyp1,
23      &  maxthetyp1,max_parm),
24      & dsc_all(ntyp1,max_parm),bsc_all(maxlob,ntyp,max_parm),
25      & censc_all(3,maxlob,ntyp,max_parm),
26      & gaussc_all(3,3,maxlob,ntyp,max_parm),dsc0_all(ntyp1,max_parm),
27      & sc_parmin_all(65,ntyp,max_parm),
28      & v0_all(maxtor,maxtor,max_parm),
29      & v1_all(maxterm,maxtor,maxtor,max_parm),
30      & v2_all(maxterm,maxtor,maxtor,max_parm),
31      & vlor1_all(maxlor,maxtor,maxtor,max_parm),
32      & vlor2_all(maxlor,maxtor,maxtor,max_parm),
33      & vlor3_all(maxlor,maxtor,maxtor,max_parm),
34      & v1c_all(2,maxtermd_1,maxtor,maxtor,maxtor,max_parm),
35      & v1s_all(2,maxtermd_1,maxtor,maxtor,maxtor,max_parm),
36      & v2c_all(maxtermd_2,maxtermd_2,maxtor,maxtor,maxtor,max_parm),
37      & v2s_all(maxtermd_2,maxtermd_2,maxtor,maxtor,maxtor,max_parm),
38      & b1_all(2,maxtor,max_parm),b2_all(2,maxtor,max_parm),
39      & cc_all(2,2,maxtor,max_parm),dd_all(2,2,maxtor,max_parm),
40      & ee_all(2,2,maxtor,max_parm),ctilde_all(2,2,maxtor,max_parm),
41      & dtilde_all(2,2,maxtor,max_parm),b1tilde_all(2,maxtor,max_parm),
42      & app_all(2,2,max_parm),bpp_all(2,2,max_parm),
43      & ael6_all(2,2,max_parm),ael3_all(2,2,max_parm),
44      & aad_all(ntyp,2,max_parm),bad_all(ntyp,2,max_parm),
45      & aa_all(ntyp,ntyp,max_parm),bb_all(ntyp,ntyp,max_parm),
46      & augm_all(ntyp,ntyp,max_parm),eps_all(ntyp,ntyp,max_parm),
47      & sigma_all(ntyp,ntyp,max_parm),r0_all(ntyp,ntyp,max_parm),
48      & chi_all(ntyp,ntyp,max_parm),chip_all(ntyp,max_parm),
49      & alp_all(ntyp,max_parm),ebr_all(max_parm),d0cm_all(max_parm),
50      & ss_depth_all(max_parm),ht_all(max_parm),
51      & akcm_all(max_parm),akth_all(max_parm),akct_all(max_parm),
52      & v1ss_all(max_parm),v2ss_all(max_parm),v3ss_all(max_parm),
53      & v1sccor_all(maxterm_sccor,3,ntyp,ntyp,max_parm),
54      & v2sccor_all(maxterm_sccor,3,ntyp,ntyp,max_parm)
55       integer nlob_all(ntyp1,max_parm),nlor_all(maxtor,maxtor,max_parm),
56      & nterm_all(maxtor,maxtor,max_parm),
57      & ntermd1_all(maxtor,maxtor,maxtor,max_parm),
58      & ntermd2_all(maxtor,maxtor,maxtor,max_parm),
59      & nbondterm_all(ntyp,max_parm),nthetyp_all(max_parm),
60      & ithetyp_all(ntyp1,max_parm),ntheterm_all(max_parm),
61      & ntheterm2_all(max_parm),ntheterm3_all(max_parm),
62      & nsingle_all(max_parm),ndouble_all(max_parm),
63      & nntheterm_all(max_parm),nterm_sccor_all(max_parm,ntyp,ntyp)
64       common /allparm/ ww_all,vbldp0_all,akp_all,vbldsc0_all,aksc_all,
65      & abond0_all,aa0thet_all,aathet_all,bbthet_all,ccthet_all,
66      & ddthet_all,eethet_all,ffthet_all,ggthet_all,
67      & a0thet_all,athet_all,bthet_all,polthet_all,gthet_all,theta0_all,
68      & sig0_all,sigc0_all,dsc_all,bsc_all,censc_all,gaussc_all,dsc0_all,
69      & sc_parmin_all,
70      & v0_all,v1_all,v2_all,vlor1_all,vlor2_all,vlor3_all,v1c_all,
71      & v1s_all,v2c_all,v2s_all,b1_all,b2_all,cc_all,dd_all,ee_all,
72      & ctilde_all,dtilde_all,b1tilde_all,app_all,bpp_all,ael6_all,
73      & ael3_all,aad_all,bad_all,aa_all,bb_all,augm_all,
74      & eps_all,sigma_all,r0_all,chi_all,chip_all,alp_all,ebr_all,
75      & ss_depth_all,ht_all,
76      & d0cm_all,akcm_all,akth_all,akct_all,v1ss_all,v2ss_all,v3ss_all,
77      & v1sccor_all,v2sccor_all,nbondterm_all,
78      & nlob_all,nlor_all,nterm_all,ntermd1_all,ntermd2_all,
79      & nthetyp_all,ithetyp_all,ntheterm_all,ntheterm2_all,ntheterm3_all,
80      & nsingle_all,ndouble_all,nntheterm_all,nterm_sccor_all