Execution Time52.57s

Test: UNRES_M_multi_Berendsen (Passed)
Build: Linux-pgi-MPI E0LL2Y (dell15) on 2024-04-16 04:15:51
Repository revision: cfd3f3ea9ccac7a6b9cb0e802b4c9e5927a506f6

Temperature distribution 1DKZcut-ber

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Test output
CTEST_FULL_OUTPUT
[dell15:183131] [[27626,0],0] ORTE_ERROR_LOG: Data unpack would read past end of buffer in file ../../orte/util/show_help.c at line 507
--------------------------------------------------------------------------
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
--------------------------------------------------------------------------
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                                                                                                                                                                                                                           
           51  opened
 thetname_pdb 
 /tmp/cdash/source/PARAM/thetaml.5parm                                                                                                                                                                                                                           
           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    51.80646546185017       sec
 Processor            0  BROADCAST time   0.1734839770942926       REDUCE time 
    1.062028987333179       GATHER time    0.000000000000000       SCATTER time
    0.1246294546872377       SENDRECV    0.000000000000000       BARRIER ene 
   0.1055694743990898       BARRIER grad   6.1620168387889862E-002
CG processor   0 is finishing work.
 Processor            1  wait times for respective orders order[            0 ]
     0.000000000000000       order[            1 ]   0.1075302939862013      
  order[            2 ]    1.007719185203314       order[            3 ] 
   0.4902576990425587       order[            4 ]    1.746495874598622      
  order[            5 ]    0.000000000000000       order[            6 ] 
    0.000000000000000       order[            7 ]    2.279713725671172      
  order[            8 ]    0.000000000000000       order[            9 ] 
    0.000000000000000       order[           10 ]    0.000000000000000     
Chi2 for fitting theoretical temperature distribution  0.0031388606