wham in lipid still diff
[unres.git] / source / wham / src-M / include_unres / COMMON.DERIV
1       double precision dcdv,dxdv,dxds,gradx,gradc,gvdwc,gelc,gvdwpp,
2      & gradx_scp,gvdwc_scp,ghpbx,ghpbc,gloc,gvdwx,gradcorr,gradxorr,
3      & gliptranc,gliptranx,
4      & gradcorr5,gradcorr6,gel_loc,gcorr3_turn,gcorr4_turn,gcorr6_turn,
5      & gel_loc_loc,gel_loc_turn3,gel_loc_turn4,gel_loc_turn6,gcorr_loc,
6      & g_corr5_loc,g_corr6_loc,gradb,gradbx,gsccorc,gsccorx,gsccor_loc,
7      & gscloc,gsclocx
8       integer nfl,icg
9       logical calc_grad
10       common /derivat/ dcdv(6,maxdim),dxdv(6,maxdim),dxds(6,maxres),
11      & gradx(3,maxres,2),gradc(3,maxres,2),gvdwx(3,maxres),
12      & gvdwc(3,maxres),gelc(3,maxres),gvdwpp(3,maxres),
13      & gradx_scp(3,maxres),
14      & gliptranc(3,-1:maxres),
15      & gliptranx(3,-1:maxres),
16      & gvdwc_scp(3,maxres),ghpbx(3,maxres),ghpbc(3,maxres),
17      & gloc(maxvar,2),gradcorr(3,maxres),gradxorr(3,maxres),
18      & gradcorr5(3,maxres),gradcorr6(3,maxres),
19      & gel_loc(3,maxres),gcorr3_turn(3,maxres),gcorr4_turn(3,maxres),
20      & gcorr6_turn(3,maxres),gradb(3,maxres),gradbx(3,maxres),
21      & gel_loc_loc(maxvar),gel_loc_turn3(maxvar),gel_loc_turn4(maxvar),
22      & gel_loc_turn6(maxvar),gcorr_loc(maxvar),
23      & g_corr5_loc(maxvar),g_corr6_loc(maxvar),gsccorc(3,maxres),
24      & gsccorx(3,maxres),gsccor_loc(maxres),
25      & gscloc(3,maxres),gsclocx(3,maxres),nfl,icg,calc_grad
26       double precision derx,derx_turn
27       common /deriv_loc/ derx(3,5,2),derx_turn(3,5,2)
28       double precision dXX_C1tab(3,maxres),dYY_C1tab(3,maxres),
29      &  dZZ_C1tab(3,maxres),dXX_Ctab(3,maxres),dYY_Ctab(3,maxres),
30      &  dZZ_Ctab(3,maxres),dXX_XYZtab(3,maxres),dYY_XYZtab(3,maxres),
31      &  dZZ_XYZtab(3,maxres)
32       common /deriv_scloc/ dXX_C1tab,dYY_C1tab,dZZ_C1tab,dXX_Ctab,
33      &  dYY_Ctab,dZZ_Ctab,dXX_XYZtab,dYY_XYZtab,dZZ_XYZtab