Sunday, September 22 2024 17:32:49
UNRES
11.10s| Exit Value | 2 |
|---|
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2
2
ns= 0
indpdb= 25 pdbref= T
Call Read_Bridge.
ns= 0
Calling MINIM_DC
SUMSL return code is 4 eval 2329
# eval/s 222.292978645225
refstr= T
after hairpin
after secondary
Total wall clock time 10.7600438594818 sec
Processor 0 BROADCAST time 1.000070571899414E-002 REDUCE time
6.915688514709473E-002 GATHER time 0.000000000000000E+000 SCATTER time
0.000000000000000E+000 SENDRECV 0.000000000000000E+000 BARRIER ene
0.526697874069214 BARRIER grad 1.056861877441406E-002
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 ]
0.176491498947144 order[ 1 ] 0.386611700057983 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 ] 1.93921065330505 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
SUMSL return code 4
CRITICAL: energy is loo large 42.6178, ene= 1.117422E+02
