CDash : UNRES

1.07s

Test: UNRES_M_ss_static_min (Failed)
Build: devel Linux-ifort-MPI-DFA_no5D NEWCORR (dell15) on 2024-11-05 04:18:25

Exit Value	1
Processors	[Graph]1

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Test output

CTEST_FULL_OUTPUT
forrtl: severe (104): incorrect POSITION= specifier value for connected file, unit 8, file /tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/1ei0_min_GB000.int
Image              PC                Routine            Line        Source             
unresMD-mult_ifor  0000000000644F60  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000065BD64  Unknown               Unknown  Unknown
unresMD-mult_ifor  000000000046A65A  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000588E5A  Unknown               Unknown  Unknown
unresMD-mult_ifor  0000000000404C22  Unknown               Unknown  Unknown
libc-2.31.so       00007FD8C94B0083  __libc_start_main     Unknown  Unknown
unresMD-mult_ifor  0000000000404B2E  Unknown               Unknown  Unknown
Bye Bye...
 1  
    
 1  
    
 indpdb=          25  pdbref= T
 Call Read_Bridge.
 ns=           4
 after etotal
 after hairpin
 after secondary
 Calling MINIM_DC
 indpdb=          25  pdbref= T
 Call Read_Bridge.
 ns=           4
 after etotal
 after hairpin
 after secondary
 Calling MINIM_DC
 SUMSL return code is           8  eval          813
 # eval/s   1898.12944269687     
 refstr= T
 after hairpin
 after secondary
CG processor   0 is finishing work.
 SUMSL return code is           8  eval          813
 # eval/s   1863.41954801047     
 refstr= T
 after hairpin
 after secondary

===================================================================================
=   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
=   RANK 1 PID 1529042 RUNNING AT dell15
=   EXIT STATUS: 104
===================================================================================
initial energy=253.914 reference=254.013
difference  .099 from reference etot 254.013 greater than 0.01