Execution Time26.98s

Test: UNRES_M_MD_microcanonical (Passed)
Build: homology Linux-pgi-MPI E0LL2Y (dell15) on 2024-03-29 04:29:11
Repository revision: e5301131661f6c05ad36e8aceadd77d37334772a


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Test output
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--------------------------------------------------------------------------
WARNING: Linux kernel CMA support was requested via the
btl_vader_single_copy_mechanism MCA variable, but CMA support is
not available due to restrictive ptrace settings.

The vader shared memory BTL will fall back on another single-copy
mechanism if one is available. This may result in lower performance.

  Local host: dell15
--------------------------------------------------------------------------
 MPI: node=             0  iseed=                  -3059742
 indpdb=            0  pdbref=  T
 Call Read_Bridge.
 ns=            0
 ns=            0
[dell15:117456] 1 more process has sent help message help-btl-vader.txt / cma-permission-denied
[dell15:117456] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages
 Total wall clock time    26.76318099349737       sec
 Processor            0  BROADCAST time   0.4576940331608057       REDUCE time 
    1.578830720856786       GATHER time    0.000000000000000       SCATTER time
    0.2583038918673992       SENDRECV    0.000000000000000       BARRIER ene 
 Processor            1  CG group            0  absolute rank            1 
  leves ERGASTULUM.
 Processor            1  wait times for respective orders order[            0 ]
    0.1382903698831797       order[            1 ]   0.1835229191929102      
  order[            2 ]    0.000000000000000       order[            3 ] 
   0.3945847898721695       BARRIER grad   0.1993556842207909     
CG processor   0 is finishing work.
    0.000000000000000       order[            4 ]    1.231467436999083      
  order[            5 ]    0.000000000000000       order[            6 ] 
    0.000000000000000       order[            7 ]   0.3752311095595360      
  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