Execution Time260.41s

Test: UNRES_M_DOCK_mremd (Passed)
Build: devel Linux-ifort-MPI_no5D E0LL2Y (dell15) on 2020-06-09 04:20:38
Repository revision: 373aa6f0a2f16a8dda57c0c8a42259d57303f6f9


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Test output
CTEST_FULL_OUTPUT
 2  
 2  
    
    
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 2  
    
    
 2  
 2  
    
    
 2  
 2  
    
    
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 2  
    
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 indpdb=          17  pdbref= T
 indpdb=          17  pdbref= T
 indpdb=          17  pdbref= T
 ns=           0
 Call Read_Bridge.
 indpdb=          17  pdbref= T
 ns=           0
 Call Read_Bridge.
 ns=           0
 indpdb=          17  pdbref= T
 Call Read_Bridge.
 ns=           0
 Call Read_Bridge.
 Call Read_Bridge.
 ns=           0
 ns=           0
 indpdb=          17  pdbref= T
 ns=           0
 Call Read_Bridge.
 ns=           0
 ns=           0
 indpdb=          17  pdbref= T
 ns=           0
 Call Read_Bridge.
 ns=           0
 ns=           0
 indpdb=          17  pdbref= T
 ns=           0
 ns=           0
 Processor           2  rest F    restart1fie T
 Call Read_Bridge.
 Processor           6  rest F    restart1fie T
 Processor           0  rest F    restart1fie T
 ns=           0
 ns=           0
 Processor           4  rest F    restart1fie T
 Processor           5  rest F    restart1fie T
 Processor           7  rest F    restart1fie T
 Processor           1  rest F    restart1fie T
 Processor           3  rest F    restart1fie T
 SC_move         430  -2.28993068777521     
 SC_move         430  -2.28877455494095     
 SC_move         430   7.23125365970579     
 SC_move         430  -3.08591023022393     
 SC_move         430  -2.29931140090055     
 SC_move         430  -2.69087361089718     
 SC_move         430  -2.28870002870487     
 SC_move         430  -2.29112932160902     
 Processor           1  CG group           0  absolute rank           1 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   5.07838559150696       order[           1 ]  0.555320501327515       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   17.2186856269836       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.980533838272095       order[
 Processor           1  CG group           1  absolute rank           3 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.88333320617676       order[           1 ]  0.538397789001465       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   17.0858917236328       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]   1.13624119758606       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   11.5791673660278       order[          10 ]  1.517057418823242E-003
 Processor           1  CG group           2  absolute rank           5 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   5.17572927474976       order[           1 ]  0.542091608047485       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   17.2666845321655       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.970676660537720       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   11.5217120647430       order[          10 ]  1.231908798217773E-003
 Processor           1  CG group           3  absolute rank           7 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.93914890289307       order[           1 ]  0.518999814987183       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   17.1276538372040       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]   1.05474400520325       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   27.1915793418884       order[          10 ]  8.678436279296875E-004
 Processor           1  CG group           4  absolute rank           9 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   5.13168764114380       order[           1 ]  0.480081558227539       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   17.0410234928131       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.823360204696655       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   21.1476414203644       order[          10 ]  8.599758148193359E-004
 Processor           1  CG group           5  absolute rank          11 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.99621415138245       order[           1 ]  0.391551733016968       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   17.0899875164032       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.920797348022461       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   27.7242267131805       order[          10 ]  1.273870468139648E-003
 Processor           1  CG group           6  absolute rank          13 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.97574758529663       order[           1 ]  0.417602300643921       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   16.6052644252777       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.932343244552612       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   28.8969874382019       order[          10 ]  8.509159088134766E-004
 Processor           1  CG group           7  absolute rank          15 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.80322694778442       order[           1 ]  0.580208778381348       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   16.8170595169067       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]   1.17723727226257       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   23.8604896068573       order[          10 ]  1.242876052856445E-003
           8 ]  0.000000000000000E+000  order[           9 ]
   17.2579393386841       order[          10 ]  1.053094863891602E-003
 Total wall clock time   259.561936855316       sec
 Processor           1  BROADCAST time   1.44617033004761       REDUCE time
   10.2471494674683       GATHER time  0.000000000000000E+000  SCATTER time
   1.69587969779968       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.436235427856445       BARRIER grad  0.591545104980469     
CG processor   1 is finishing work.
 Total wall clock time   259.563222885132       sec
 Processor           3  BROADCAST time   1.41431236267090       REDUCE time
   9.98034954071045       GATHER time  0.000000000000000E+000  SCATTER time
   1.68873190879822       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.896242380142212       BARRIER grad  0.583705902099609     
CG processor   3 is finishing work.
 Total wall clock time   259.558113813400       sec
 Processor           4  BROADCAST time   1.39000606536865       REDUCE time
   9.42791557312012       GATHER time  0.000000000000000E+000  SCATTER time
   1.75078773498535       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.453578472137451       BARRIER grad  0.509612321853638     
CG processor   4 is finishing work.
 Total wall clock time   259.558107852936       sec
 Processor           5  BROADCAST time   1.17557263374329       REDUCE time
Bye Bye...
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Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
   7.75105762481689       GATHER time  0.000000000000000E+000  SCATTER time
   1.32641124725342       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.439572334289551       BARRIER grad  0.418161153793335     
CG processor   5 is finishing work.
 Total wall clock time   259.562007904053       sec
 Processor           6  BROADCAST time   1.11059308052063       REDUCE time
   8.07094335556030       GATHER time  0.000000000000000E+000  SCATTER time
   1.29681301116943       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.495809316635132       BARRIER grad  0.391626596450806     
CG processor   6 is finishing work.
 Total wall clock time   259.556656122208       sec
 Processor           7  BROADCAST time   1.38892316818237       REDUCE time
   10.5052907466888       GATHER time  0.000000000000000E+000  SCATTER time
   1.71129012107849       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.771957159042358       BARRIER grad  0.640672922134399     
CG processor   7 is finishing work.
 Total wall clock time   259.560341119766       sec
 Processor           0  BROADCAST time   1.42669939994812       REDUCE time
   9.00661969184875       GATHER time  0.000000000000000E+000  SCATTER time
   1.68339133262634       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.495522975921631       BARRIER grad  0.447989225387573     
CG processor   0 is finishing work.
 Total wall clock time   259.563666820526       sec
 Processor           2  BROADCAST time   1.33910846710205       REDUCE time
   9.66861915588379       GATHER time  0.000000000000000E+000  SCATTER time
   1.66475558280945       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.460533857345581       BARRIER grad  0.529547929763794     
CG processor   2 is finishing work.
ACC   1   270.00000     0.35176  199
ACC   2   280.00000     0.53266  199
ACC   3   290.00000     0.50251  199
ACC   4   300.00000     0.39698  199
ACC   5   310.00000     0.61307  199
ACC   6   320.00000     0.69849  199
ACC   7   330.00000     0.51256  199
average exchange = 0.515433