CDash : UNRES

5.58s

Test: UNRES_M_multi_min (Passed)
Build: devel Linux-ifort-MPI_no5D E0LL2Y (dell15) on 2023-05-28 04:50:48
Repository revision: 3d79e89922e83ded1dd9fe7689d30b45567bd6ef

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Test output

CTEST_FULL_OUTPUT
Bye Bye...
Bye Bye...
 2  
    
 2  
    
 indpdb=          25  pdbref= T
 ns=           0
 Call Read_Bridge.
 ns=           0
 after etotal
 after hairpin
 after secondary
 Calling MINIM_DC
 SUMSL return code is           4  eval         2139
 # eval/s   396.040496387278     
 refstr= T
 after hairpin
 after secondary
 Processor           1  CG group           0  absolute rank           1 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
  8.846926689147949E-002  order[           1 ]  0.204210042953491       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]  0.000000000000000E+000  order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]   1.20666718482971       order[
           8 ]  0.000000000000000E+000  order[           9 ]
  0.000000000000000E+000  order[          10 ]  0.000000000000000E+000
 Total wall clock time   5.45363092422485       sec
 Processor           0  BROADCAST time  7.048606872558594E-003  REDUCE time
  4.670929908752441E-002  GATHER time  0.000000000000000E+000  SCATTER time
  0.000000000000000E+000  SENDRECV  0.000000000000000E+000  BARRIER ene
  3.397226333618164E-003  BARRIER grad  3.343582153320312E-003
CG processor   0 is finishing work.
SUMSL return code 4
OK: absdiff= 1.0924, ene= -3.226007E+02