Saturday, September 21 2024 06:45:13
UNRES
13.10s| Energy 1l2y_micro | |
|---|---|
| Exit Value | 1 |
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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 12.6818308830261 sec
Processor 0 BROADCAST time 0.184082984924316 REDUCE time
0.729125976562500 order[ 1 ] 0.118264436721802 order[
2 ] 0.000000000000000E+000 order[ 3 ]
0.000000000000000E+000 order[ 4 ] 1.12920594215393 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 0.390452623367310 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
1.12011671066284 GATHER time 0.000000000000000E+000 SCATTER time
9.198164939880371E-002 SENDRECV 0.000000000000000E+000 BARRIER ene
0.717275142669678 BARRIER grad 0.127122402191162
CG processor 0 is finishing work.
average total energy 188.051
standard deviation 0.0024414
difference 6.879 from reference ave etot 181.172 greater than 6.0
