X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc_MD-M%2Funres.F;h=0e924f7171a12cec203fe6e1de9adab17446d445;hb=e37f70b1095e1599ae2765a45a8955e7b43ac267;hp=03576c457a892eee2ea5e3604b0deb1c58eb0db8;hpb=6304fe426dd266ba99503f2cc4a5b9d396511b2f;p=unres.git diff --git a/source/unres/src_MD-M/unres.F b/source/unres/src_MD-M/unres.F index 03576c4..0e924f7 100644 --- a/source/unres/src_MD-M/unres.F +++ b/source/unres/src_MD-M/unres.F @@ -730,10 +730,12 @@ c enddo c do j=1,3 c dc(j,0)=ran_number(-0.2d0,0.2d0) c enddo + if (constr_homology.eq.0) then usampl=.true. totT=1.d0 eq_time=0.0d0 call read_fragments + endif call chainbuild_cart call cartprint call intout