Friday, September 20 2024 05:57:14
UNRES
30.33s
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[dell15:88707] [[64049,0],0] ORTE_ERROR_LOG: Data unpack had inadequate space in file ../../orte/util/show_help.c at line 513
[dell15:88707] [[64049,0],0] ORTE_ERROR_LOG: Data unpack had inadequate space in file ../../orte/util/show_help.c at line 513
MPI: node= 0 iseed= -3059742
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 ]
0.2455462776124477 order[ 1 ] 0.2477004369720817
Total wall clock time 29.81414914876223 sec
order[ 2 ] 0.000000000000000 order[ 3 ]
0.000000000000000 order[ 4 ] 1.840417397208512
order[ 5 ] 0.000000000000000 order[ 6 ]
0.000000000000000 order[ 7 ] 0.5438670031726360
order[ 8 ] 0.000000000000000 order[ 9 ]
0.000000000000000 order[ 10 ] 0.000000000000000
Processor 0 BROADCAST time 0.6271286802366376 REDUCE time
1.773120138794184 GATHER time 0.000000000000000 SCATTER time
0.3872173428535461 SENDRECV 0.000000000000000 BARRIER ene
0.2977537037804723 BARRIER grad 0.1807919424027205
CG processor 0 is finishing work.
Warning: ieee_invalid is signaling
Warning: ieee_denorm is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_underflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Warning: ieee_invalid is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_inexact is signaling
Bye Bye...
average total energy 74.2783
standard deviation 0.00385358
average total energy 74.2783
standard deviation 0.00385358
