Execution Time262.54s

Test: UNRES_M_DOCK_mremd (Passed)
Build: devel Linux-ifort-MPI_no5D E0LL2Y (dell15) on 2020-06-17 04:23:25
Repository revision: 95cc80884174e2d4316e46f0fb50a061a1e20f76


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Test output
CTEST_FULL_OUTPUT
 2  
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 ns=           0
 indpdb=          17  pdbref= T
 ns=           0
 Call Read_Bridge.
 ns=           0
 ns=           0
 ns=           0
 ns=           0
 ns=           0
 indpdb=          17  pdbref= T
 Call Read_Bridge.
 ns=           0
 ns=           0
 indpdb=          17  pdbref= T
 Call Read_Bridge.
 ns=           0
 indpdb=          17  pdbref= T
 Call Read_Bridge.
 ns=           0
 indpdb=          17  pdbref= T
 Call Read_Bridge.
 ns=           0
 Processor           0  rest F    restart1fie T
 ns=           0
 Processor           5  rest F    restart1fie T
 Processor           3  rest F    restart1fie T
 Processor           4  rest F    restart1fie T
 indpdb=          17  pdbref= T
 Processor           6  rest F    restart1fie T
 Call Read_Bridge.
 ns=           0
 indpdb=          17  pdbref= T
 indpdb=          17  pdbref= T
 Call Read_Bridge.
 ns=           0
 Call Read_Bridge.
 ns=           0
 Processor           2  rest F    restart1fie T
 Processor           1  rest F    restart1fie T
 Processor           7  rest F    restart1fie T
 SC_move         430  -2.28993068777521     
 SC_move         430  -2.28877455494095     
 SC_move         430  -3.08591023022393     
 SC_move         430  -2.29112932160902     
 SC_move         430  -2.29931140090055     
 SC_move         430   7.23125365970579     
 SC_move         430  -2.69087361089718     
 SC_move         430  -2.28870002870487     
 Processor           1  CG group           0  absolute rank           1 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.55911922454834       order[           1 ]  0.480942010879517       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   15.8093695640564       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]   1.05708527565002       order[
           8 ]  0.000000000000000E+000  order[           9 ]
 Processor           1  CG group           1  absolute rank           3 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.75287985801697       order[           1 ]  0.379170417785645       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   13.9921538829803       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.999359130859375       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   44.5062508583069       order[          10 ]  1.278877258300781E-003
 Processor           1  CG group           2  absolute rank           5 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.68039631843567       order[           1 ]  0.374417304992676       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   14.7955768108368       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.851608276367188       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   29.6466352939606       order[          10 ]  8.208751678466797E-004
 Processor           1  CG group           3  absolute rank           7 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.43856191635132       order[           1 ]  0.470773935317993       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   15.5556130409241       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.981480836868286       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   28.3154113292694       order[          10 ]  1.079082489013672E-003
 Processor           1  CG group           4  absolute rank           9 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   5.19151592254639       order[           1 ]  0.516758918762207       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   17.1218698024750       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.900746107101440       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   16.3127739429474       order[          10 ]  1.206159591674805E-003
 Processor           1  CG group           5  absolute rank          11 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.84674620628357       order[           1 ]  0.513402223587036       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   16.7835197448730       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]   1.05658030509949       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   28.9741156101227       order[          10 ]  1.244783401489258E-003
 Processor           1  CG group           6  absolute rank          13 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   3.93823933601379       order[           1 ]  0.450629234313965       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   13.7395346164703       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  0.985526561737061       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   17.8334469795227       order[          10 ]  1.119136810302734E-003
 Processor           1  CG group           7  absolute rank          15 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
   4.83911466598511       order[           1 ]  0.448162078857422       order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]   16.2531445026398       order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]   1.11228346824646       order[
           8 ]  0.000000000000000E+000  order[           9 ]
   30.8473894596100       order[          10 ]  1.250028610229492E-003
   27.7874674797058       order[          10 ]  7.870197296142578E-004
 Total wall clock time   261.611529111862       sec
 Processor           1  BROADCAST time  0.889757633209229       REDUCE time
   7.27540946006775       GATHER time  0.000000000000000E+000  SCATTER time
   1.09271526336670       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.568586111068726       BARRIER grad  0.380228519439697     
CG processor   1 is finishing work.
 Total wall clock time   261.597805976868       sec
 Total wall clock time   261.605273962021       sec
 Processor           2  BROADCAST time  0.982957601547241       REDUCE time
   8.23501682281494       GATHER time  0.000000000000000E+000  SCATTER time
   1.18135547637939       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.656341791152954       BARRIER grad  0.454152345657349     
CG processor   2 is finishing work.
 Total wall clock time   261.597116947174       sec
 Processor           4  BROADCAST time   1.45196008682251       REDUCE time
   9.88311100006104       GATHER time  0.000000000000000E+000  SCATTER time
   1.69160389900208       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.481069564819336       BARRIER grad  0.477006912231445     
CG processor   4 is finishing work.
 Total wall clock time   261.595679998398       sec
 Processor           5  BROADCAST time   1.44747877120972       REDUCE time
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...
Bye Bye...
Bye Bye...
   9.64222383499146       GATHER time  0.000000000000000E+000  SCATTER time
   1.66626596450806       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.617601156234741       BARRIER grad  0.511759757995605     
CG processor   5 is finishing work.
 Total wall clock time   261.597579002380       sec
 Processor           6  BROADCAST time   1.09246468544006       REDUCE time
   11.4768891334534       GATHER time  0.000000000000000E+000  SCATTER time
   1.44117450714111       SENDRECV  0.000000000000000E+000  BARRIER ene
   2.60866260528564       BARRIER grad  0.794002532958984     
CG processor   6 is finishing work.
 Total wall clock time   261.597590923309       sec
 Processor           7  BROADCAST time   1.13699603080750       REDUCE time
   7.71251893043518       GATHER time  0.000000000000000E+000  SCATTER time
   1.31091499328613       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.473345041275024       BARRIER grad  0.441154479980469     
CG processor   7 is finishing work.
 Processor           3  BROADCAST time   1.36202645301819       REDUCE time
   9.85442829132080       GATHER time  0.000000000000000E+000  SCATTER time
   1.57508778572083       SENDRECV  0.000000000000000E+000  BARRIER ene
   1.68365406990051       BARRIER grad  0.552353382110596     
CG processor   3 is finishing work.
 Total wall clock time   261.613306045532       sec
 Processor           0  BROADCAST time   1.21192550659180       REDUCE time
   9.31756305694580       GATHER time  0.000000000000000E+000  SCATTER time
   1.47958159446716       SENDRECV  0.000000000000000E+000  BARRIER ene
  0.847638607025146       BARRIER grad  0.527101755142212     
CG processor   0 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