Execution Time1.87s

Test: UNRES_M_ss_static_min (Failed)
Build: devel Linux-gfortan-MPI-DFA E0LL2Y (dell15) on 2020-03-22 04:16:07
Repository revision: b0b2c84acad12a1d979380324a23283282aaa48a

Exit Value1

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Test output
CTEST_FULL_OUTPUT
STOP Bye Bye...
STOP Bye Bye...
 1  
 1  
    
    
 indpdb=          25  pdbref= T
 indpdb=          25  pdbref= T
 Call Read_Bridge.
 Call Read_Bridge.
 ns=           4
 ns=           4
 after etotal
 after etotal
 after hairpin
 after hairpin
 after secondary
 Calling MINIM_DC
 after secondary
 Calling MINIM_DC
 SUMSL return code is           8  eval          205
 # eval/s   719.50749312359778     
 refstr= T
 after hairpin
 after secondary
 SUMSL return code is           8  eval         1257
 # eval/s   727.91497589236621     
 refstr= T
 after hairpin
 after secondary
CG processor   1 is finishing work.
CG processor   0 is finishing work.
initial energy=127.042 reference=127.044
SUMSL return code 20
ERROR = SUMSL return code 20 is not 4
but not failing this test, it is known problem with dissulfides
WARNING: energy is somewhat different 10.384300, ene= -138.201900