Fixes made in connection to Hamiltonian replica exchange in homology restraints
[unres.git] / source / cluster / wham / src / probabl.F
index 3071d4c..420d6f7 100644 (file)
@@ -115,7 +115,7 @@ c        write (iout,*) "i",i," ii",ii
           call etotal(energia(0),fT)
           totfree(i)=energia(0)
 #ifdef DEBUG
-          write (iout,*) i," energia",(energia(j),j=0,20)
+          write (iout,*) "Conformation",i
           call enerprint(energia(0),ft)
       write (iout,'(a,3(3x,a5),5x,3(3x,a5))')
      & "Residue","X(CA)","Y(CA)","Z(CA)","X(SC)","Y(SC)","Z(SC)"
@@ -125,7 +125,7 @@ c        write (iout,*) "i",i," ii",ii
      &    (c(j,ires+nres),j=1,3)
       enddo
 
-          call intout
+c          call intout
           call flush(iout)
 #endif
           do k=1,max_ene