X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc_MD-M%2FCOMMON.DERIV;h=97395db4c5e245b1ae821abc4ad1251e3677ae4e;hb=05c18ccfcefc037cb8394bd779a4e51b7cbea6ec;hp=fcfe46011c54febcf86f61bcccc60fa6b9f03184;hpb=d09b54932dd8b227a90f50766bae56f6bf66189c;p=unres.git diff --git a/source/unres/src_MD-M/COMMON.DERIV b/source/unres/src_MD-M/COMMON.DERIV index fcfe460..97395db 100644 --- a/source/unres/src_MD-M/COMMON.DERIV +++ b/source/unres/src_MD-M/COMMON.DERIV @@ -2,7 +2,11 @@ & gvdwpp,gel_loc,gel_loc_long,gvdwc_scpp,gliptranc,gliptranx, & gradx_scp,gvdwc_scp,ghpbx,ghpbc,gloc,gloc_x,dtheta,dphi,dalpha, & domega,gscloc,gsclocx,gradcorr,gradcorr_long,gradcorr5_long, - & gradcorr6_long,gcorr6_turn_long,gvdwx,gshieldx,gradafm + & gradcorr6_long,gcorr6_turn_long,gvdwx,gshieldx,gradafm, + & gshieldc, gshieldc_loc, gshieldx_ec, gshieldc_ec, + & gshieldc_loc_ec, gshieldx_t3,gshieldc_t3,gshieldc_loc_t3, + & gshieldx_t4, gshieldc_t4,gshieldc_loc_t4,gshieldx_ll, + & gshieldc_ll, gshieldc_loc_ll integer nfl,icg common /derivat/ dcdv(6,maxdim),dxdv(6,maxdim),dxds(6,maxres), & gradx(3,-1:maxres,2),gradc(3,-1:maxres,2),gvdwx(3,-1:maxres),