Monday, September 23 2024 13:26:29
UNRES
16.24s| Energy 1l2y_micro |
|---|
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CTEST_FULL_OUTPUT
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2
2
indpdb= 0 pdbref= T
ns= 0
Call Read_Bridge.
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 15.8136980533600 sec
Processor 0 BROADCAST time 0.225694417953491 REDUCE time
1.24049139022827 GATHER time 0.000000000000000E+000 SCATTER time
9.985208511352539E-002 SENDRECV 0.000000000000000E+000 BARRIER ene
0.108616352081299 BARRIER grad 0.160032510757446
CG processor 0 is finishing work.
0.738495826721191 order[ 1 ] 0.141473531723022 order[
2 ] 0.000000000000000E+000 order[ 3 ]
0.000000000000000E+000 order[ 4 ] 1.16455245018005 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 0.415317058563232 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
average total energy 79.5989
standard deviation 0.00205993
