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correction of gen_rand_conf and preminim
[unres4.git]
/
source
/
unres
/
MD.F90
diff --git
a/source/unres/MD.F90
b/source/unres/MD.F90
index
0acdaf7
..
a3451ec
100644
(file)
--- a/
source/unres/MD.F90
+++ b/
source/unres/MD.F90
@@
-2513,8
+2513,10
@@
if (overlapsc) then
print *, 'Calling OVERLAP_SC'
call overlap_sc(fail)
if (overlapsc) then
print *, 'Calling OVERLAP_SC'
call overlap_sc(fail)
+ print *,'after OVERLAP'
endif
if (searchsc) then
endif
if (searchsc) then
+ print *,'call SC_MOVE'
call sc_move(2,nres-1,10,1d10,nft_sc,etot)
print *,'SC_move',nft_sc,etot
if(me.eq.king.or..not.out1file) &
call sc_move(2,nres-1,10,1d10,nft_sc,etot)
print *,'SC_move',nft_sc,etot
if(me.eq.king.or..not.out1file) &