Execution Time0.54s

Test: UNRES_M_ss_static_min (Failed)
Build: devel Linux-gfortan-MPI E0LL2Y (dell15) on 2020-03-20 22:01:34
Repository revision: 01df9c4e865c1c5c100a7132ed5a0819a5b52410

Exit Value2

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Test output
CTEST_FULL_OUTPUT
STOP Bye Bye...
STOP Bye Bye...
 1  
 1  
    
    
 indpdb=          25  pdbref= T
 Call Read_Bridge.
 indpdb=          25  pdbref= T
 Call Read_Bridge.
 ns=           4
 ns=           4
 after etotal
 after hairpin
 after secondary
 Calling MINIM_DC
 after etotal
 after hairpin
 after secondary
 Calling MINIM_DC
 SUMSL return code is           4  eval            2
 # eval/s   319.68780487804878     
 refstr= T
 after hairpin
 after secondary
 SUMSL return code is           8  eval          205
 # eval/s   697.24350220728718     
 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 4
CRITICAL: energy is loo large 275.627900, ene= 127.041700