X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Funres%2Fsrc_MD-M%2Fminimize_p.F;h=06c7a7366ff90350b84f3948668b036b094ff1d7;hb=5e13bfdf2c98103be8166d5d2bbf9269c40e63a4;hp=902dde25fa09b7e00abfc88de1a87d3164514323;hpb=f0ab76db798e4461535a3ce519bf1188744a7d9b;p=unres.git diff --git a/source/unres/src_MD-M/minimize_p.F b/source/unres/src_MD-M/minimize_p.F index 902dde2..06c7a73 100644 --- a/source/unres/src_MD-M/minimize_p.F +++ b/source/unres/src_MD-M/minimize_p.F @@ -44,14 +44,14 @@ c DO WHILE (NOT_DONE) * controls output iv(19)=2 * selects output unit -c iv(21)=iout iv(21)=0 + if (print_min_ini+print_min_stat+print_min_res.gt.0) iv(21)=iout * 1 means to print out result - iv(22)=0 + iv(22)=print_min_res * 1 means to print out summary stats - iv(23)=0 + iv(23)=print_min_stat * 1 means to print initial x and d - iv(24)=0 + iv(24)=print_min_ini * min val for v(radfac) default is 0.1 v(24)=0.1D0 * max val for v(radfac) default is 4.0 @@ -435,14 +435,14 @@ c---------------------------------------------------------- * controls output iv(19)=2 * selects output unit -c iv(21)=iout - iv(21)=0 + iv(21)=0 + if (print_min_ini+print_min_stat+print_min_res.gt.0) iv(21)=iout * 1 means to print out result - iv(22)=0 + iv(22)=print_min_res * 1 means to print out summary stats - iv(23)=0 + iv(23)=print_min_stat * 1 means to print initial x and d - iv(24)=0 + iv(24)=print_min_ini * min val for v(radfac) default is 0.1 v(24)=0.1D0 * max val for v(radfac) default is 4.0