CDash : UNRES

0.66s

Test: UNRES_MIN_prota (Passed)
Build: Linux-ifort-noMPI E0LL2Y (dell15) on 2024-06-30 03:08:12

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Test output

CTEST_FULL_OUTPUT
Inside initialize thetname_pdb 
 /tmp/cdash/source/PARAM/thetaml.5parm                                          
                                                                                
                                                                                
                    
          51  opened
********************************************************************************
United-residue force field calculation - serial job.
********************************************************************************
 indpdb=          25  pdbref= T
 Call Read_Bridge.
 ns=           0
 after etotal
 Calling MINIM_DC
 check_ecart before sumsl
 check_ecart
 SUMSL return code is           4  eval          720
 # eval/s   1242.10098777263     
 refstr= T
********** Program terminated normally.
SUMSL return code 4
OK: absdiff= .000800, ene= -154.961400