Execution Time96.05s

Test: UNRES_remd_dfa (Passed)
Build: devel Linux-ifort-MPI-DFA_no5D E0LL2Y (dell15) on 2024-03-07 04:55:54
Repository revision: 3d79e89922e83ded1dd9fe7689d30b45567bd6ef

Histograms remd_dfa
Energy remd_dfa

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Test output
CTEST_FULL_OUTPUT
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 1  
    
 1  
 1  
    
    
 1  
 1  
    
 1  
    
 1  
    
 1  
    
    
 indpdb=          45  pdbref= T
 indpdb=          45  pdbref= T
 indpdb=          45  pdbref= T
 indpdb=          45  pdbref= T
 indpdb=          45  pdbref= T
 indpdb=          45  pdbref= T
 indpdb=          45  pdbref= T
 indpdb=          45  pdbref= T
 Call Read_Bridge.
 Call Read_Bridge.
 Call Read_Bridge.
 Call Read_Bridge.
 Call Read_Bridge.
 Call Read_Bridge.
 Call Read_Bridge.
 Call Read_Bridge.
 ishiftca=           1 ilastca=          76
 init_dfa_vars finished!
 ishiftca=           1 ilastca=          76
 init_dfa_vars finished!
 ishiftca=           1 ilastca=          76
 init_dfa_vars finished!
 ishiftca=           1 ilastca=          76
 init_dfa_vars finished!
 ishiftca=           1 ilastca=          76
 init_dfa_vars finished!
 ishiftca=           1 ilastca=          76
 init_dfa_vars finished!
 ishiftca=           1 ilastca=          76
 init_dfa_vars finished!
 ishiftca=           1 ilastca=          76
 init_dfa_vars finished!
 read_dfa_info finished!
 ns=           0
 read_dfa_info finished!
 ns=           0
 read_dfa_info finished!
 ns=           0
 read_dfa_info finished!
 ns=           0
 read_dfa_info finished!
 ns=           0
 read_dfa_info finished!
 ns=           0
 read_dfa_info finished!
 ns=           0
 read_dfa_info finished!
 ns=           0
 Processor           1  rest F    restart1fie T
 Processor           5  rest F    restart1fie T
 Processor           6  rest F    restart1fie T
 Processor           0  rest F    restart1fie T
 Processor           2  rest F    restart1fie T
 Processor           3  rest F    restart1fie T
 Processor           4  rest F    restart1fie T
 Processor           7  rest F    restart1fie T
 SC_move         670   82.0662467696093     
 SC_move         670   105.310864867078     
 SC_move         670   144.355741380146     
 SC_move         670   124.547565673304     
 SC_move         670   124.547565673304     
 SC_move         670   88.5854083432199     
 SC_move         670   85.6262719103616     
 SC_move         670   106.702014940560     
CG processor   0 is finishing work.
CG processor   2 is finishing work.
CG processor   3 is finishing work.
CG processor   1 is finishing work.
CG processor   4 is finishing work.
CG processor   5 is finishing work.
CG processor   6 is finishing work.
CG processor   7 is finishing work.
/usr/lib/pymodules/python2.7/matplotlib/axes.py:2760: UserWarning: Attempting to set identical bottom==top results
in singular transformations; automatically expanding.
bottom=0, top=0
  + 'bottom=%s, top=%s') % (bottom, top))


ACC   1   240.00000     0.03030   99
ACC   2   260.00000     0.02020   99
ACC   3   280.00000     0.22222   99
ACC   4   300.00000     0.13131   99
ACC   5   320.00000     0.07071   99
ACC   6   340.00000     0.41414   99
ACC   7   360.00000     0.01010   99
average exchange = 0.128426