CTEST_FULL_OUTPUT
STOP Bye Bye...
STOP Bye Bye...
MPI: node= 1 iseed= -2222665
indpdb= 25 pdbref= T
Call Read_Bridge.
ns= 4
dc 6.0099999999999998
dc 6.0099999999999998 15.358000000000001 -0.60600000000000009
MPI: node= 0 iseed= -1111332
indpdb= 25 pdbref= T
after etotal
after hairpin
after secondary
Calling MINIM_DC
Call Read_Bridge.
ns= 4
dc 6.0099999999999998
dc 6.0099999999999998 15.358000000000001 -0.60600000000000009
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 8 eval 282
# eval/s 728.57877599594929
refstr= T
after hairpin
after secondary
SUMSL return code is 8 eval 282
# eval/s 729.83621050838906
refstr= T
after hairpin
after secondary
CG processor 0 is finishing work.
CG processor 1 is finishing work.
initial energy=134.706 reference=134.706
SUMSL return code 20
ERROR = SUMSL return code 20 is not 4
but not failing this test, it is known problem with dissulfides
WARNING: energy is somewhat different 11.024800, ene= -153.022400