X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc-HCD-5D%2FCOMMON.INTERACT;h=8c4876dcaf72d39f61df3b1464514dd2f4590908;hb=57038e4bdff4cc9534106b25bfbd4b9a844d47fd;hp=14d92ef9ed614e8af7097eb4a4b1f5610186fc5b;hpb=48ae9e01d2dd6571fa2cca6c704dc04f86e5fd7b;p=unres.git diff --git a/source/unres/src-HCD-5D/COMMON.INTERACT b/source/unres/src-HCD-5D/COMMON.INTERACT index 14d92ef..8c4876d 100644 --- a/source/unres/src-HCD-5D/COMMON.INTERACT +++ b/source/unres/src-HCD-5D/COMMON.INTERACT @@ -21,6 +21,23 @@ & iscpstart(maxres,maxint_gr),iscpend(maxres,maxint_gr), & iatsc_s,iatsc_e,iatel_s,iatel_e,iatel_s_vdw,iatel_e_vdw, & iatscp_s,iatscp_e,ispp,iscp +C 3/26/20 Interaction lists + integer newcontlisti(maxint_res*maxres), + & newcontlistj(maxint_res*maxres), + & newcontlistppi(maxint_res*maxres), + & newcontlistppj(maxint_res*maxres), + & newcontlistpp_vdwi(maxint_res*maxres), + & newcontlistpp_vdwj(maxint_res*maxres), + & newcontlistscpi(2*maxint_res*maxres), + & newcontlistscpj(2*maxint_res*maxres), + & g_listscsc_start,g_listscsc_end,g_listpp_start,g_listpp_end, + & g_listpp_vdw_start,g_listpp_vdw_end,g_listscp_start,g_listscp_end + common /interact_list/newcontlisti,newcontlistj,g_listscsc_start, + & g_listscsc_end,newcontlistppi,newcontlistppj,g_listpp_start, + & g_listpp_end,newcontlistpp_vdwi,newcontlistpp_vdwj, + & g_listpp_vdw_start,g_listpp_vdw_end, + & newcontlistscpi,newcontlistscpj,g_listscp_start, + & g_listscp_end C 12/1/95 Array EPS included in the COMMON block. double precision eps,epslip,sigma,sigmaii,rs0,chi,chip,alp, & sigma0,sigii,