X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;ds=inline;f=source%2Funres%2Fio.F90;h=4750e579ee861416b994ecdb6493941cbf6c9971;hb=91b9f78d94b96277537615722323ebe03cc0a014;hp=8ec3d1934523d157abaf5525e91b65615033fbbe;hpb=c2b8cd6399133f378681275a7498952235472c0a;p=unres4.git diff --git a/source/unres/io.F90 b/source/unres/io.F90 index 8ec3d19..4750e57 100644 --- a/source/unres/io.F90 +++ b/source/unres/io.F90 @@ -1015,7 +1015,7 @@ ! print *,'Finished reading pdb data' if(me.eq.king.or..not.out1file) & - write (iout,'(a,i3,a,i3)')'nsup=',nsup,& + write (iout,'(a,i7,a,i7)')'nsup=',nsup,& ' nstart_sup=',nstart_sup !,"ergwergewrgae" !el if(.not.allocated(itype_pdb)) allocate(itype_pdb(nres)) @@ -1239,7 +1239,9 @@ ! print *,"tu dochodze" ! znamy nres oraz nss można zaalokowac potrzebne tablice call alloc_geo_arrays + print *,"after alloc_geo_arrays" call alloc_ener_arrays + print *,"after alloc_ener_arrays" !-------------------------------- ! 8/13/98 Set limits to generating the dihedral angles do i=1,nres @@ -1396,7 +1398,7 @@ if (itype(nres,molnum(nres)).eq.ntyp1_molec(molnum(nres))) nct=nct-1 if (pdbref) then if(me.eq.king.or..not.out1file) & - write (iout,'(a,i3)') 'nsup=',nsup + write (iout,'(a,i7)') 'nsup=',nsup nstart_seq=nnt if (nsup.le.(nct-nnt+1)) then do i=0,nct-nnt+1-nsup