Friday, September 20 2024 10:57:07
UNRES
0.98s| Exit Value | 2 |
|---|
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2
2
indpdb= 25 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
Calling MINIM_DC
LBFGS return code isIterLimit eval 10009
# eval/s 13826.1295554479
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 ]
7.691144943237305E-003 order[ 1 ] 2.090930938720703E-004 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 ] 0.268212318420410 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
Total wall clock time 0.831498146057129 sec
Processor 0 BROADCAST time 4.491806030273438E-004 REDUCE time
3.658533096313477E-003 GATHER time 0.000000000000000E+000 SCATTER time
0.000000000000000E+000 SENDRECV 0.000000000000000E+000 BARRIER ene
3.709793090820312E-004 BARRIER grad 2.610683441162109E-004
CG processor 0 is finishing work.
SUMSL return code
ERROR = SUMSL return code is not 4
but not failing this test, it is known problem with esccor
CRITICAL: energy is loo large 39.789400, ene= 147.876500
