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more scaling time step
[unres4.git]
/
source
/
unres
/
compare.F90
diff --git
a/source/unres/compare.F90
b/source/unres/compare.F90
index
eb8ea68
..
45ed3e5
100644
(file)
--- a/
source/unres/compare.F90
+++ b/
source/unres/compare.F90
@@
-4196,7
+4196,7
@@
do i=nnt,nct
if (itype(i,1).ne.10) then
!d print *,'i=',i,' itype=',itype(i,1),' theta=',theta(i+1)
do i=nnt,nct
if (itype(i,1).ne.10) then
!d print *,'i=',i,' itype=',itype(i,1),' theta=',theta(i+1)
- call gen_side(itype(i,1),theta(i+1),alph(i),omeg(i),fail)
+ call gen_side(itype(i,1),theta(i+1),alph(i),omeg(i),fail,1)
endif
enddo
call chainbuild
endif
enddo
call chainbuild
@@
-4212,7
+4212,7
@@
alph0=alph(ind_sc)
omeg0=omeg(ind_sc)
call gen_side(itype(ind_sc,1),theta(ind_sc+1),alph(ind_sc),&
alph0=alph(ind_sc)
omeg0=omeg(ind_sc)
call gen_side(itype(ind_sc,1),theta(ind_sc+1),alph(ind_sc),&
- omeg(ind_sc),fail)
+ omeg(ind_sc),fail,1)
call chainbuild
call etotal(energia)
!d write (iout,'(a,i5,a,i4,2(a,f8.3),2(a,1pe14.5))')
call chainbuild
call etotal(energia)
!d write (iout,'(a,i5,a,i4,2(a,f8.3),2(a,1pe14.5))')