X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=source%2Funres%2Fsrc_MD-M%2Freadrtns_CSA.F;fp=source%2Funres%2Fsrc_MD-M%2Freadrtns_CSA.F;h=c2d08874557d5533711937265a4e485e200fd7ac;hp=e89d8ce2b1d76c2dbee26e961ee4168eabedff19;hb=94c9f54ff76d22351c0cd2f1b01e809515163940;hpb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a diff --git a/source/unres/src_MD-M/readrtns_CSA.F b/source/unres/src_MD-M/readrtns_CSA.F index e89d8ce..c2d0887 100644 --- a/source/unres/src_MD-M/readrtns_CSA.F +++ b/source/unres/src_MD-M/readrtns_CSA.F @@ -1036,18 +1036,7 @@ C initial geometry. 40 continue endif #else - do itrial=1,100 - itmp=1 - call gen_rand_conf(itmp,*30) - goto 40 - 30 write (iout,*) 'Failed to generate random conformation', - & ', itrial=',itrial - write (*,*) 'Failed to generate random conformation', - & ', itrial=',itrial - enddo - write (iout,'(a,i3,a)') 'Processor:',me, - & ' error in generating random conformation.' - write (*,'(a,i3,a)') 'Processor:',me, + write (*,'(a)') & ' error in generating random conformation.' stop 40 continue @@ -2036,7 +2025,7 @@ c print *,"Processor",myrank," fg_rank",fg_rank mol2name=prefix(:lenpre)//'_'//pot(:lenpot)//'.mol2' statname=prefix(:lenpre)//'_'//pot(:lenpot)//'.stat' if (lentmp.gt.0) - & call copy_to_tmp(pref_orig(:ile(pref_orig))//'_'//pot(:lenpot)// + & call copy_to_tmp(pref_orig(:ilen(pref_orig))//'_'//pot(:lenpot) & //'.stat') rest2name=prefix(:ilen(prefix))//'.rst' if(usampl) then