Saturday, September 21 2024 19:28:32
UNRES
8.86s| Exit Value | 2 |
|---|
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2
2
indpdb= 25 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
Calling MINIM_DC
SUMSL return code is 4 eval 2329
# eval/s 276.062088305140
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 ]
0.141841173171997 order[ 1 ] 0.386100769042969 order[
Total wall clock time 8.65866398811340 sec
Processor 0 BROADCAST time 7.585048675537109E-003 REDUCE time
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 ] 1.57542324066162 order[
8 ] 0.000000000000000E+000 order[ 9 ]
4.722595214843750E-002 GATHER time 0.000000000000000E+000 SCATTER time
0.000000000000000E+000 SENDRECV 0.000000000000000E+000 BARRIER ene
0.299740552902222 BARRIER grad 6.961584091186523E-003
CG processor 0 is finishing work.
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
SUMSL return code 4
CRITICAL: energy is loo large 42.6178, ene= 1.117422E+02
