X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fcluster%2Fwham%2Fsrc-M%2Fread_coords.F;h=ac11ac0267ae0ca0d84d21eb4954c3dc3a79dbc2;hb=24d71016d39facb439708acae299529762f51e81;hp=17f39a3b089590bd04e537a2b672d0e5c447fbb1;hpb=bbeeae96ba3edb7acbb8e7e41c0e1cb8a969e025;p=unres.git diff --git a/source/cluster/wham/src-M/read_coords.F b/source/cluster/wham/src-M/read_coords.F index 17f39a3..ac11ac0 100644 --- a/source/cluster/wham/src-M/read_coords.F +++ b/source/cluster/wham/src-M/read_coords.F @@ -178,13 +178,13 @@ c through a ring. #endif endif -#define DEBUG +C#define DEBUG #ifdef DEBUG write (iout,*) "Opening file ",intinname(:ilen(intinname)) write (iout,*) "lenrec",lenrec_in call flush(iout) #endif -#undef DEBUG +C#undef DEBUG c write (iout,*) "maxconf",maxconf i=0 do while (.true.) @@ -283,6 +283,7 @@ c write (iout,*) "nss",nss enddo enddo endif +#define DEBUG #ifdef DEBUG write (iout,'(5hREAD ,i5,3f15.4,i10)') & jj+1,energy(jj+1),entfac(jj+1), @@ -292,6 +293,7 @@ c write (iout,*) "nss",nss write (iout,'(8f10.5)') ((c(j,i+nres),j=1,3),i=nnt,nct) call flush(iout) #endif +#undef DEBUG call add_new_cconf(jjj,jj,jj_old,icount,Next) enddo 101 continue @@ -640,10 +642,11 @@ c------------------------------------------------------------------------------ integer i,j,ij,ii,iii integer len character*16 form,acc - character*32 nam + character*80 nam c c Read conformations off a DA scratchfile. c +#define DEBUG #ifdef DEBUG write (iout,*) "DAREAD_COORDS" write (iout,*) "istart_conf",istart_conf," iend_conf",iend_conf @@ -680,7 +683,10 @@ c & nss_all(ij),(ihpb_all(i,ij),jhpb_all(i,ij),i=1,nss), & jhpb_all(i,ij),i=1,nss) call flush(iout) #endif +#undef DEBUG enddo + write (iout,*) "just before leave" + call flush(iout) return end c------------------------------------------------------------------------------