X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-M%2Fgeomout.F;h=6747e76d24137e8b44b599a29687837c09b21706;hb=9a02ad420612f67ae897b1a54d13c10d1de772d3;hp=c9110ae085db7750a78d3ce6bdc5a752f22bc344;hpb=5a9c41de10a0c6daf93c0e1c42de016d57444a74;p=unres.git diff --git a/source/wham/src-M/geomout.F b/source/wham/src-M/geomout.F index c9110ae..6747e76 100644 --- a/source/wham/src-M/geomout.F +++ b/source/wham/src-M/geomout.F @@ -54,11 +54,11 @@ write (ipdb,30) ica(nct),ica(nct)+1 endif do i=1,nss - if (dyn_ss) then - write (iunit,30) ica(idssb(i))+1,ica(jdssb(i))+1 - else - write (ipdb,30) ica(ihpb(i)-nres)+1,ica(jhpb(i)-nres)+1 - endif +C if (dyn_ss) then +C write (iunit,30) ica(idssb(i))+1,ica(jdssb(i))+1 +C else +C write (ipdb,30) ica(ihpb(i)-nres)+1,ica(jhpb(i)-nres)+1 +C endif enddo write (ipdb,'(a6)') 'ENDMDL' 10 FORMAT ('ATOM',I7,' CA ',A3,1X,A1,I4,4X,3F8.3,f15.3)