1 double precision dcdv,dxdv,dxds,gradx,gradc,gvdwc,gelc,gvdwpp,
2 & gradx_scp,gvdwc_scp,ghpbx,ghpbc,gloc,gvdwx,gradcorr,gradxorr,
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,gshieldx,gradafm,
8 & gshieldc, gshieldc_loc, gshieldx_ec, gshieldc_ec,
9 & gshieldc_loc_ec, gshieldx_t3,gshieldc_t3,gshieldc_loc_t3,
10 & gshieldx_t4, gshieldc_t4,gshieldc_loc_t4,gshieldx_ll,
11 & gshieldc_ll, gshieldc_loc_ll,gsaxsC,gsaxsX
15 common /derivat/ dcdv(6,maxdim),dxdv(6,maxdim),dxds(6,maxres),
16 & gradx(3,maxres,2),gradc(3,maxres,2),gvdwx(3,maxres),
17 & gvdwc(3,maxres),gelc(3,maxres),gvdwpp(3,maxres),
18 & gradx_scp(3,maxres),
19 & gliptranc(3,-1:maxres),
20 & gliptranx(3,-1:maxres),
21 & gshieldx(3,-1:maxres), gshieldc(3,-1:maxres),
22 & gshieldc_loc(3,-1:maxres),
23 & gshieldx_ec(3,-1:maxres), gshieldc_ec(3,-1:maxres),
24 & gshieldc_loc_ec(3,-1:maxres),
25 & gshieldx_t3(3,-1:maxres), gshieldc_t3(3,-1:maxres),
26 & gshieldc_loc_t3(3,-1:maxres),
27 & gshieldx_t4(3,-1:maxres), gshieldc_t4(3,-1:maxres),
28 & gshieldc_loc_t4(3,-1:maxres),
29 & gshieldx_ll(3,-1:maxres), gshieldc_ll(3,-1:maxres),
30 & gshieldc_loc_ll(3,-1:maxres),
31 & gvdwc_scp(3,maxres),ghpbx(3,maxres),ghpbc(3,maxres),
32 & gsaxsC(3,-1:maxres),gsaxsX(3,-1:maxres),
33 & gloc(maxvar,2),gradcorr(3,maxres),gradxorr(3,maxres),
34 & gradcorr5(3,maxres),gradcorr6(3,maxres),
35 & gel_loc(3,maxres),gcorr3_turn(3,maxres),gcorr4_turn(3,maxres),
36 & gcorr6_turn(3,maxres),gradb(3,maxres),gradbx(3,maxres),
37 & gel_loc_loc(maxvar),gel_loc_turn3(maxvar),gel_loc_turn4(maxvar),
38 & gel_loc_turn6(maxvar),gcorr_loc(maxvar),
39 & g_corr5_loc(maxvar),g_corr6_loc(maxvar),gsccorc(3,maxres),
40 & gsccorx(3,maxres),gsccor_loc(maxres),
41 & gscloc(3,maxres),gsclocx(3,maxres),nfl,icg,calc_grad
42 double precision derx,derx_turn
43 common /deriv_loc/ derx(3,5,2),derx_turn(3,5,2)
44 double precision dXX_C1tab(3,maxres),dYY_C1tab(3,maxres),
45 & dZZ_C1tab(3,maxres),dXX_Ctab(3,maxres),dYY_Ctab(3,maxres),
46 & dZZ_Ctab(3,maxres),dXX_XYZtab(3,maxres),dYY_XYZtab(3,maxres),
47 & dZZ_XYZtab(3,maxres)
48 common /deriv_scloc/ dXX_C1tab,dYY_C1tab,dZZ_C1tab,dXX_Ctab,
49 & dYY_Ctab,dZZ_Ctab,dXX_XYZtab,dYY_XYZtab,dZZ_XYZtab