Tuesday, September 17 2024 07:50:27
UNRES
6.71s| Exit Value | 1 |
|---|
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MPI: node= 0 iseed= -3059742
indpdb= 25 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
dc 65.9170000000000
dc 65.9170000000000 122.683500000000 48.0835000000000
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 4 eval 2116
# eval/s 325.105769859484
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 ]
5.249094963073730E-002 order[ 1 ] 0.321893930435181 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 ] 1.68057203292847 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
Total wall clock time 6.58266115188599 sec
Processor 0 BROADCAST time 4.017257690429688E-002 REDUCE time
5.462121963500977E-002 GATHER time 0.000000000000000E+000 SCATTER time
0.000000000000000E+000 SENDRECV 0.000000000000000E+000 BARRIER ene
3.756999969482422E-003 BARRIER grad 3.297567367553711E-003
CG processor 0 is finishing work.
SUMSL return code 4
WARNING: energy is somewhat different 8.428200, ene= -323.693100
