Friday, September 20 2024 20:46:08
UNRES
2.31s| Exit Value | 2 |
|---|
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2
2
JESTEM
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indpdb= 25 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
Calling MINIM_DC
SUMSL return code is 8 eval 707
# eval/s 355.669733397590
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ]
2.395725250244141E-002 order[ 1 ] 5.279064178466797E-002 order[
2 ] 0.000000000000000E+000 order[ 3 ]
0.000000000000000E+000 order[ 4 ] 0.000000000000000E+000 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 0.318856000900269 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
Total wall clock time 2.13809514045715 sec
Processor 0 BROADCAST time 1.872062683105469E-003 REDUCE time
9.813547134399414E-003 GATHER time 0.000000000000000E+000 SCATTER time
0.000000000000000E+000 SENDRECV 0.000000000000000E+000 BARRIER ene
1.115083694458008E-003 BARRIER grad 1.013517379760742E-003
CG processor 0 is finishing work.
SUMSL return code 8
ERROR = SUMSL return code 8 is not 4
but not failing this test, it is known problem with esccor
CRITICAL: energy is loo large 46.324500, ene= -277.368600
