X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc-HCD-5D%2Fmake_xx_list.F;h=a69ee13927b94055961e0fdfc29b40766f3130bf;hb=5aac27f7c6317fa0975184363614b42716034716;hp=a83740fb8cecbe4417ed5a53c205615fb5855cf5;hpb=fd10e81284102e5a8466e05c87f0202979a2f00b;p=unres.git diff --git a/source/unres/src-HCD-5D/make_xx_list.F b/source/unres/src-HCD-5D/make_xx_list.F index a83740f..a69ee13 100644 --- a/source/unres/src-HCD-5D/make_xx_list.F +++ b/source/unres/src-HCD-5D/make_xx_list.F @@ -12,7 +12,7 @@ double precision xi,yi,zi,xj,yj,zj,xj_safe,yj_safe,zj_safe, & xj_temp,yj_temp,zj_temp double precision dist_init, dist_temp,r_buff_list - integer contlisti(200*maxres),contlistj(200*maxres) + integer contlisti(2000*maxres),contlistj(2000*maxres) ! integer :: newcontlisti(200*nres),newcontlistj(200*nres) integer i,j,itypi,itypj,subchap,xshift,yshift,zshift,iint, & ilist_sc,g_ilist_sc @@ -164,12 +164,12 @@ c write(iout,*) "before bcast",g_ilist_sc double precision xi,yi,zi,xj,yj,zj,xj_safe,yj_safe,zj_safe, & xj_temp,yj_temp,zj_temp double precision dist_init, dist_temp,r_buff_list - integer contlistscpi(200*maxres),contlistscpj(200*maxres) + integer contlistscpi(2000*maxres),contlistscpj(2000*maxres) ! integer :: newcontlistscpi(200*nres),newcontlistscpj(200*nres) integer i,j,itypi,itypj,subchap,xshift,yshift,zshift,iint, & ilist_scp,g_ilist_scp integer displ(0:max_fg_procs),i_ilist_scp(0:max_fg_procs),ierr - integer contlistscpi_f(200*maxres),contlistscpj_f(200*maxres) + integer contlistscpi_f(2000*maxres),contlistscpj_f(2000*maxres) integer ilist_scp_first,ifirstrun,g_ilist_sc ! print *,"START make_SC" #ifdef DEBUG @@ -349,7 +349,7 @@ c write(iout,*) "before bcast",g_ilist_sc & xmedi,ymedi,zmedi double precision dx_normi,dy_normi,dz_normi,dxj,dyj,dzj, & dx_normj,dy_normj,dz_normj - integer contlistpp_vdwi(200*maxres),contlistpp_vdwj(200*maxres) + integer contlistpp_vdwi(2000*maxres),contlistpp_vdwj(2000*maxres) ! integer :: newcontlistppi(200*nres),newcontlistppj(200*nres) integer i,j,itypi,itypj,subchap,xshift,yshift,zshift,iint, & ilist_pp_vdw,g_ilist_pp_vdw @@ -509,7 +509,7 @@ c write(iout,*) "before bcast",g_ilist_sc & xmedi,ymedi,zmedi double precision dx_normi,dy_normi,dz_normi,dxj,dyj,dzj, & dx_normj,dy_normj,dz_normj - integer contlistppi(200*maxres),contlistppj(200*maxres) + integer contlistppi(2000*maxres),contlistppj(2000*maxres) ! integer :: newcontlistppi(200*nres),newcontlistppj(200*nres) integer i,j,itypi,itypj,subchap,xshift,yshift,zshift,iint, & ilist_pp,g_ilist_pp