CTEST_FULL_OUTPUT
Note: The following floating-point exceptions are signalling: IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
Note: The following floating-point exceptions are signalling: IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
1
1
indpdb= 25 pdbref= T
indpdb= 25 pdbref= T
Call Read_Bridge.
ns= 4
Call Read_Bridge.
ns= 4
after etotal
after hairpin
after secondary
Calling MINIM_DC
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 8 eval 654
# eval/s 2241.6529234671698
refstr= T
after hairpin
after secondary
SUMSL return code is 8 eval 654
# eval/s 2170.3996702158552
refstr= T
after hairpin
after secondary
CG processor 0 is finishing work.
CG processor 1 is finishing work.
initial energy=253.914 reference=127.044
difference 126.870 from reference etot 127.044 greater than 0.01