Saturday, October 05 2024 22:22:11
UNRES
6.08s| Exit Value | 2 |
|---|
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2
2
ns= 0
indpdb= 25 pdbref= T
Call Read_Bridge.
ns= 0
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 4 eval 2569
# eval/s 440.938068251408
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
Total wall clock time 5.90637302398682 sec
Processor 1 wait times for respective orders order[ 0 ]
0.107589006423950 order[ 1 ] 0.245747089385986 order[
2 ] 0.000000000000000E+000 order[ 3 ]
0.000000000000000E+000 order[ 4 ] 0.000000000000000E+000 order[
Processor 0 BROADCAST time 6.407260894775391E-003 REDUCE time
3.919863700866699E-002 GATHER time 0.000000000000000E+000 SCATTER time
0.000000000000000E+000 SENDRECV 0.000000000000000E+000 BARRIER ene
3.850460052490234E-003 BARRIER grad 3.406286239624023E-003
CG processor 0 is finishing work.
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 1.52193689346313 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
SUMSL return code 4
CRITICAL: energy is loo large 431.780200, ene= 108.087100
