Execution Time95.02s

Test: UNRES_M_Berendsen (Passed)
Build: Linux-pgi-MPI E0LL2Y (dell15) on 2024-03-07 04:07:41
Repository revision: cfd3f3ea9ccac7a6b9cb0e802b4c9e5927a506f6

Temperature distribution 1L2Y_B

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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
--------------------------------------------------------------------------
[dell15:126417] 1 more process has sent help message help-btl-vader.txt / cma-permission-denied
[dell15:126417] 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_underflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Warning: ieee_invalid is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_underflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
 thetname_pdb 
 /tmp/cdash/source/PARAM/thetaml.5parm                                                                                                                                                                                                                           
           51  opened
 thetname_pdb 
 /tmp/cdash/source/PARAM/thetaml.5parm                                                                                                                                                                                                                           
           51  opened
 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.
 Total wall clock time    94.13368363119662       sec
 Processor            0  BROADCAST time    1.177101954817772       REDUCE time 
    7.655473062768579       GATHER time    0.000000000000000       SCATTER time
     1.361030524596572       SENDRECV    0.000000000000000       BARRIER ene 
   0.9046003967523575       BARRIER grad   0.6266575977206230     
CG processor   0 is finishing work.
 Processor            1  wait times for respective orders order[            0 ]
     0.000000000000000       order[            1 ]    1.265493975952268      
  order[            2 ]    3.049965115264058       order[            3 ] 
    1.857216184958816       order[            4 ]    5.885519979521632      
  order[            5 ]    0.000000000000000       order[            6 ] 
    0.000000000000000       order[            7 ]    2.422112533822656      
  order[            8 ]    0.000000000000000       order[            9 ] 
    0.000000000000000       order[           10 ]    0.000000000000000     
Chi2 for fitting theoretical temperature distribution  0.0010589410