Wednesday, September 18 2024 03:16:34
UNRES
29.31s
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CTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
[dell15:117689] [[27403,0],0] ORTE_ERROR_LOG: Data unpack had inadequate space in file ../../orte/util/show_help.c at line 513
[dell15:117689] [[27403,0],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
Call Read_Bridge.
ns= 0
ns= 0
Total wall clock time 29.03476373665035 sec
Processor 0 BROADCAST time 0.4802134344354272 REDUCE time
1.748850417323411 GATHER time 0.000000000000000 SCATTER time
0.2700484627857804 SENDRECV 0.000000000000000 BARRIER ene
0.3569738762453198 BARRIER grad 0.1750828027725220
CG processor 0 is finishing work.
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ]
0.1315658576786518 order[ 1 ] 0.2395759597420692
order[ 2 ] 0.000000000000000 order[ 3 ]
0.000000000000000 order[ 4 ] 1.480843453668058
order[ 5 ] 0.000000000000000 order[ 6 ]
0.000000000000000 order[ 7 ] 0.4375725053250790
order[ 8 ] 0.000000000000000 order[ 9 ]
0.000000000000000 order[ 10 ] 0.000000000000000
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
