Execution Time0.28s

Test: UNRES_M_ss_static_min (Passed)
Build: devel Linux-ifort-MPI-5D-DFA NEWCORR (dell15) on 2020-04-13 04:55:07
Repository revision: 5673961eec8f29bcff4be10a73b31f835ac927db


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Test output
CTEST_FULL_OUTPUT
Bye Bye...
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 1  
    
 1  
    
 indpdb=          25  pdbref= T
 indpdb=          25  pdbref= T
 Call Read_Bridge.
 ns=           4
 Call Read_Bridge.
 ns=           4
 Calling MINIM_DC
 Calling MINIM_DC
 LBFGS return code isIntplnErr eval            7
 # eval/s   565.466045221679     
 refstr= T
 after hairpin
 LBFGS return code isIntplnErr eval            7
 # eval/s   566.065667958432     
 refstr= T
 after hairpin
 after secondary
 after secondary
CG processor   0 is finishing work.
CG processor   1 is finishing work.
initial energy=254.013 reference=254.013
SUMSL return code
ERROR = SUMSL return code is not 4
but not failing this test, it is known problem with dissulfides
OK: absdiff= 0, ene= 2.540128E+02