X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fcluster%2Fwham%2Fsrc%2FCOMMON.FFIELD;h=fdc40cb36d2b6db93d31234ecf1cf76b450b55f0;hb=104351c8c3f9ed80809ee190a69da275532ec4dc;hp=ccafd30bf08d82bff49b996f42356d461209c1f1;hpb=478a9d9a1c99eb3f4bc4ca676ff3162bdd01d633;p=unres.git diff --git a/source/cluster/wham/src/COMMON.FFIELD b/source/cluster/wham/src/COMMON.FFIELD index ccafd30..fdc40cb 100644 --- a/source/cluster/wham/src/COMMON.FFIELD +++ b/source/cluster/wham/src/COMMON.FFIELD @@ -6,13 +6,15 @@ C----------------------------------------------------------------------- double precision wsc,wscp,welec,wstrain,wtor,wtor_d,wang,wscloc, & wcorr,wcorr4,wcorr5,wcorr6,wsccor,wel_loc,wturn3,wturn4,wturn6, & wvdwpp,wbond,weights,scal14,scalscp,cutoff_corr,delt_corr, - & r0_corr + & r0_corr,wdfa_dist,wdfa_tor,wdfa_nei,wdfa_beta integer ipot,n_ene_comp,rescale_mode common /ffield/ wsc,wscp,welec,wstrain,wtor,wtor_d,wang,wscloc, & wcorr,wcorr4,wcorr5,wcorr6,wsccor,wel_loc,wturn3,wturn4,wturn6, - & wvdwpp,wbond,weights(max_ene),scalscp, - & scal14,cutoff_corr,delt_corr,r0_corr,ipot,n_ene_comp, - & rescale_mode + & wvdwpp,wbond, + & wdfa_dist,wdfa_tor,wdfa_nei,wdfa_beta, + & weights(max_ene),scalscp, + & scal14,cutoff_corr,delt_corr,r0_corr,ipot,n_ene_comp, + & rescale_mode common /potentials/ potname(5) character*3 potname C-----------------------------------------------------------------------