Execution Time19.87s

Test: UNRES_M_multi_microcanonical (Passed)
Build: Linux-pgi-MPI E0LL2Y (dell15) on 2024-04-19 04:11:00
Repository revision: cfd3f3ea9ccac7a6b9cb0e802b4c9e5927a506f6


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Test output
CTEST_FULL_OUTPUT
--------------------------------------------------------------------------
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
--------------------------------------------------------------------------
[dell15:97860] 1 more process has sent help message help-btl-vader.txt / cma-permission-denied
[dell15:97860] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages
Warning: ieee_invalid is signaling
Warning: ieee_divide_by_zero 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...
 thetname_pdb 
 /tmp/cdash/source/PARAM/thetaml.5parm                                                                                                                                                                                                                           
 thetname_pdb 
 /tmp/cdash/source/PARAM/thetaml.5parm                                                                                                                                                                                                                           
           51  opened
           51  opened
 MPI: node=             0  iseed=                  -3059742
 indpdb=           19  pdbref=  T
 ns=            0
 Call Read_Bridge.
 ns=            0
 Processor            1  CG group            0  absolute rank            1 
  leves ERGASTULUM.
 Total wall clock time    19.69597119651735       sec
 Processor            0  BROADCAST time   7.9976208508014679E-002  REDUCE time 
   0.2591038513928652       GATHER time    0.000000000000000       SCATTER time
    2.8232157230377197E-002  SENDRECV    0.000000000000000       BARRIER ene 
   1.8116043880581856E-002  BARRIER grad   1.4197578653693199E-002
CG processor   0 is finishing work.
 Processor            1  wait times for respective orders order[            0 ]
    0.2076378613710403       order[            1 ]   2.2449502721428871E-002 
  order[            2 ]    0.000000000000000       order[            3 ] 
    0.000000000000000       order[            4 ]   0.4302010163664818      
  order[            5 ]    0.000000000000000       order[            6 ] 
    0.000000000000000       order[            7 ]    1.755492173135281      
  order[            8 ]    0.000000000000000       order[            9 ] 
    0.000000000000000       order[           10 ]    0.000000000000000     
average total energy  -173.628
standard deviation  0.00037058