Sunday, September 22 2024 05:39:46
UNRES
21.00s| Energy 1l2y_micro |
|---|
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CTEST_FULL_OUTPUT
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2
2
indpdb= 0 pdbref= T
Call Read_Bridge.
ns= 0
ns= 0
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ]
Total wall clock time 20.4272799491882 sec
Processor 0 BROADCAST time 0.209143877029419 REDUCE time
1.33764290809631 GATHER time 0.000000000000000E+000 SCATTER time
0.100725650787354 SENDRECV 0.000000000000000E+000 BARRIER ene
0.249824523925781 BARRIER grad 0.191551208496094
CG processor 0 is finishing work.
0.682986259460449 order[ 1 ] 0.132606744766235 order[
2 ] 0.000000000000000E+000 order[ 3 ]
0.000000000000000E+000 order[ 4 ] 1.29440617561340 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 0.471039533615112 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
average total energy 79.5989
standard deviation 0.00205993
