X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc_MD%2Fenergy_p_new_barrier.F;h=13c3c725300dc83b83481cbb32d80667765d0b78;hb=66980167b703e10af937168c72d113e607e4323d;hp=236fdc2234948352bd42d3527d40b43765a5489c;hpb=c131b73555ef3436ee4f01794133097fd341d3b6;p=unres.git diff --git a/source/unres/src_MD/energy_p_new_barrier.F b/source/unres/src_MD/energy_p_new_barrier.F index 236fdc2..13c3c72 100644 --- a/source/unres/src_MD/energy_p_new_barrier.F +++ b/source/unres/src_MD/energy_p_new_barrier.F @@ -4399,7 +4399,7 @@ C 15/02/13 CC dynamic SSbond - additional check if (ii.gt.nres .and. iabs(itype(iii)).eq.1 .and. & iabs(itype(jjj)).eq.1) then call ssbond_ene(iii,jjj,eij) - ehpb=ehpb+2*eij + ehpb=ehpb+eij endif cd write (iout,*) "eij",eij cd & ' waga=',waga,' fac=',fac