Execution Time55.13s

Test: UNRES_remd_dfa (Passed)
Build: devel Linux-ifort-MPI-DFA_no5D E0LL2Y (dell15) on 2024-10-30 04:11:49

Histograms remd_dfaFile /tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/dfa/1L2Y_remd_ene_hist.png not found
Energy remd_dfaFile /tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/dfa/1L2Y_remd_Tene.png not found
Processors[Graph]1

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Test output
CTEST_FULL_OUTPUT
forrtl: severe (104): incorrect POSITION= specifier value for connected file, unit 17, file /tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/dfa/remd_dfa_GB000.stat
Image              PC                Routine            Line        Source             
unresMD-mult_ifor  0000000000642E20  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000659C24  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000046BFFF  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004B55A4  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004C7FD9  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000058607F  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000404C22  Unknown               Unknown  Unknown
libc-2.31.so       00007F1F610D6083  __libc_start_main     Unknown  Unknown
unresMD-mult_ifor  0000000000404B2E  Unknown               Unknown  Unknown
forrtl: severe (104): incorrect POSITION= specifier value for connected file, unit 17, file /tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/dfa/remd_dfa_GB000.stat
Image              PC                Routine            Line        Source             
unresMD-mult_ifor  0000000000642E20  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000659C24  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000046BFFF  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004B55A4  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004C7FD9  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000058607F  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000404C22  Unknown               Unknown  Unknown
libc-2.31.so       00007F1B527F0083  __libc_start_main     Unknown  Unknown
unresMD-mult_ifor  0000000000404B2E  Unknown               Unknown  Unknown
forrtl: severe (104): incorrect POSITION= specifier value for connected file, unit 17, file /tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/dfa/remd_dfa_GB000.stat
Image              PC                Routine            Line        Source             
unresMD-mult_ifor  0000000000642E20  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000659C24  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000046BFFF  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004B55A4  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004C7FD9  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000058607F  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000404C22  Unknown               Unknown  Unknown
libc-2.31.so       00007EFD9BCAC083  __libc_start_main     Unknown  Unknown
unresMD-mult_ifor  0000000000404B2E  Unknown               Unknown  Unknown
forrtl: severe (104): incorrect POSITION= specifier value for connected file, unit 17, file /tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/dfa/remd_dfa_GB000.stat
Image              PC                Routine            Line        Source             
unresMD-mult_ifor  0000000000642E20  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000659C24  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000046BFFF  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004B55A4  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004C7FD9  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000058607F  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000404C22  Unknown               Unknown  Unknown
libc-2.31.so       00007F628C332083  __libc_start_main     Unknown  Unknown
unresMD-mult_ifor  0000000000404B2E  Unknown               Unknown  Unknown
forrtl: severe (104): incorrect POSITION= specifier value for connected file, unit 17, file /tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/dfa/remd_dfa_GB000.stat
Image              PC                Routine            Line        Source             
unresMD-mult_ifor  0000000000642E20  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000659C24  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000046BFFF  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004B55A4  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004C7FD9  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000058607F  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000404C22  Unknown               Unknown  Unknown
libc-2.31.so       00007F14377DB083  __libc_start_main     Unknown  Unknown
unresMD-mult_ifor  0000000000404B2E  Unknown               Unknown  Unknown
forrtl: severe (104): incorrect POSITION= specifier value for connected file, unit 17, file /tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/dfa/remd_dfa_GB000.stat
Image              PC                Routine            Line        Source             
unresMD-mult_ifor  0000000000642E20  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000659C24  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000046BFFF  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004B55A4  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004C7FD9  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000058607F  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000404C22  Unknown               Unknown  Unknown
libc-2.31.so       00007F6B0D2A6083  __libc_start_main     Unknown  Unknown
unresMD-mult_ifor  0000000000404B2E  Unknown               Unknown  Unknown
forrtl: severe (104): incorrect POSITION= specifier value for connected file, unit 17, file /tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/dfa/remd_dfa_GB000.stat
Image              PC                Routine            Line        Source             
unresMD-mult_ifor  0000000000642E20  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000659C24  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000046BFFF  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004B55A4  Unknown               Unknown  Unknown
unresMD-mult_ifor  00000000004C7FD9  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000058607F  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000404C22  Unknown               Unknown  Unknown
libc-2.31.so       00007F66A4736083  __libc_start_main     Unknown  Unknown
unresMD-mult_ifor  0000000000404B2E  Unknown               Unknown  Unknown
Bye Bye...
 1  
    
 1  
    
 indpdb=          45  pdbref= T
 Call Read_Bridge.
 1  
    
 1  
    
 indpdb=          45  pdbref= T
 1  
    
 Call Read_Bridge.
 1  
    
 1  
    
 1  
    
 indpdb=          45  pdbref= T
 indpdb=          45  pdbref= T
 Call Read_Bridge.
 Call Read_Bridge.
 indpdb=          45  pdbref= T
 indpdb=          45  pdbref= T
 Call Read_Bridge.
 Call Read_Bridge.
 indpdb=          45  pdbref= T
 indpdb=          45  pdbref= T
 Call Read_Bridge.
 Call Read_Bridge.
 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
 Processor           0  rest F    restart1fie T
 Processor           0  rest F    restart1fie T
 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
 Processor           0  rest F    restart1fie T
 Processor           0  rest F    restart1fie T
 Processor           0  rest F    restart1fie T
 Processor           0  rest F    restart1fie T
 Processor           0  rest F    restart1fie T
 Processor           0  rest F    restart1fie T
 SC_move         670   106.702014940560     
 SC_move         670   106.702014940560     
 SC_move         670   106.702014940560     
 SC_move         670   106.702014940560     
 SC_move         670   106.702014940560     
 SC_move         670   106.702014940560     
 SC_move         670   106.702014940560     
 SC_move         670   106.702014940560     
CG processor   0 is finishing work.

===================================================================================
=   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
=   RANK 0 PID 249448 RUNNING AT dell15
=   EXIT STATUS: 104
===================================================================================

===================================================================================
=   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
=   RANK 2 PID 249450 RUNNING AT dell15
=   EXIT STATUS: 104
===================================================================================

===================================================================================
=   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
=   RANK 3 PID 249451 RUNNING AT dell15
=   EXIT STATUS: 104
===================================================================================

===================================================================================
=   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
=   RANK 4 PID 249452 RUNNING AT dell15
=   EXIT STATUS: 104
===================================================================================

===================================================================================
=   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
=   RANK 5 PID 249453 RUNNING AT dell15
=   EXIT STATUS: 104
===================================================================================

===================================================================================
=   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
=   RANK 6 PID 249454 RUNNING AT dell15
=   EXIT STATUS: 104
===================================================================================

===================================================================================
=   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
=   RANK 7 PID 249455 RUNNING AT dell15
=   EXIT STATUS: 104
===================================================================================
Traceback (most recent call last):
  File "./matplotlib_hist.py", line 3, in <module>
    import matplotlib
ImportError: No module named matplotlib


awk: cmd. line:1: fatal: division by zero attempted
average exchange = 
(standard_in) 1: syntax error
./prota_unres_energy_check_mult.sh: line 273: [: !=: unary operator expected