CDash : UNRES

9.99s

Test: UNRES_M_MD_microcanonical (Passed)
Build: Linux-ifort-MPI E0LL2Y (dell15) on 2024-05-16 03:11:44

Processors	[Graph]1

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Test output

CTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
 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
 Total wall clock time   9.93487191200256       sec
 Processor           0  BROADCAST time  0.167223453521729       REDUCE time
   1.09066224098206       GATHER time  0.000000000000000E+000  SCATTER time
  8.126139640808105E-002  SENDRECV  0.000000000000000E+000  BARRIER ene
  8.452844619750977E-002  BARRIER grad  0.141620635986328     
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 ]
  0.282447576522827       order[           1 ]  0.135634183883667       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]  0.942289590835571       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.346749544143677       order[
           8 ]  0.000000000000000E+000  order[           9 ]
  0.000000000000000E+000  order[          10 ]  0.000000000000000E+000
Bye Bye...
Bye Bye...
average total energy  74.2564
standard deviation  0.0417769
average total energy  74.2564
standard deviation  0.0417769