Friday, September 20 2024 01:20:38
UNRES
6.69s| Exit Value | 2 |
|---|
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2
2
indpdb= 25 pdbref= T
Call Read_Bridge.
ns= 0
ns= 0
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 4 eval 2569
# eval/s 399.279646795472
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 ]
0.239148139953613 order[ 1 ] 0.346850395202637 order[
Total wall clock time 6.47009515762329 sec
Processor 0 BROADCAST time 1.236820220947266E-002 REDUCE time
8.049869537353516E-002 GATHER time 0.000000000000000E+000 SCATTER time
0.000000000000000E+000 SENDRECV 0.000000000000000E+000 BARRIER ene
5.601525306701660E-002 BARRIER grad 4.334211349487305E-003
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 ] 1.54824090003967 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
CG processor 0 is finishing work.
SUMSL return code 4
CRITICAL: energy is loo large 46.2729, ene= 1.080871E+02
