CTEST_FULL_OUTPUT
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
MPI: node= 0 iseed= -1111332
MPI: node= 1 iseed= -2222665
indpdb= 25 pdbref= T
indpdb= 25 pdbref= T
Call Read_Bridge.
ns= 4
Call Read_Bridge.
ns= 4
dc 6.0099999999999998
dc 6.0099999999999998 15.358000000000001 -0.60600000000000009
dc 6.0099999999999998
dc 6.0099999999999998 15.358000000000001 -0.60600000000000009
after etotal
after etotal
after hairpin
after hairpin
after secondary
Calling MINIM_DC
after secondary
Calling MINIM_DC
SUMSL return code is 8 eval 251
# eval/s 632.21967370827599
refstr= T
after hairpin
after secondary
SUMSL return code is 8 eval 251
# eval/s 614.10766903749561
refstr= T
after hairpin
after secondary
CG processor 0 is finishing work.
CG processor 1 is finishing work.
initial energy=-1089437000000000013895850874266726638411672581482844750094466540353168339734888448 reference=134.706
difference 10894370000000000138958508742667266384116725814828447500944665403531\ 68339734888582.706 from reference etot 134.706 greater than 0.01