Tuesday, September 17 2024 20:37:20
UNRES
0.17s| Exit Value | 1 |
|---|---|
| Processors | [Graph]1 |
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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_DENORMAL
STOP Bye Bye...
2
2
indpdb= 25 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 4 eval 2
# eval/s 293.63651638196586
refstr= T
after hairpin
after secondary
Total wall clock time 5.9311866760253906E-002 sec
Processor 0 BROADCAST time 1.5497207641601562E-005 REDUCE time 5.3882598876953125E-005 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 1.2874603271484375E-005 BARRIER grad 0.0000000000000000
CG processor 0 is finishing work.
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ] 3.7193298339843750E-004 order[ 1 ] 6.0134700169990685E-154 order[ 2 ] 6.0134700169990685E-154 order[ 3 ] 6.0134700169990685E-154 order[ 4 ] 6.0134700169990685E-154 order[ 5 ] 1.1561278366813913E-310 order[ 6 ] 6.0134700169990685E-154 order[ 7 ] 1.8460750579833984E-003 order[ 8 ] 4.9406564584124654E-324 order[ 9 ] 1.1561278367419143E-310 order[ 10 ] 4.6842122735248991E-310
SUMSL return code 23
ERROR = SUMSL return code 23 is not 4
but not failing this test, it is known problem with esccor
(standard_in) 1: illegal character: \
(standard_in) 1: syntax error
(standard_in) 1: syntax error
./prota_unres_energy_check_mult.sh: line 315: [: -eq: unary operator expected
(standard_in) 1: syntax error
./prota_unres_energy_check_mult.sh: line 322: [: -eq: unary operator expected
WARNING: energy is somewhat different , ene= 10000000000000000000000000000000000000000000000000000000000000000000\
00000000000000000000000000000000.000000
