CDash : UNRES

0.35s

Test: UNRES_M_ENE1_prota (Passed)
Build: homology Linux-pgi-MPI E0LL2Y (dell15) on 2024-03-06 04:29:02
Repository revision: e5301131661f6c05ad36e8aceadd77d37334772a

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Test output

CTEST_FULL_OUTPUT
 MPI: node=             0  iseed=                  -3059742
 indpdb=           23  pdbref=  T
    0.000000000000000         0.000000000000000     
           45           46           47
    1.975000000000001        -2.016999999999999     
           45           46           47
  -0.8720000000000000        -3.216000000000000     
           45           46           47
    3.169000000000000        0.4340000000000002     
 just before leave
    0.000000000000000         0.000000000000000     
            2            3            4
   0.9150000000000000        -1.552000000000000     
            2            3            4
    3.316000000000000         2.116000000000000     
            2            3            4
   -1.558000000000000         2.759000000000000     
 just before leave
 Call Read_Bridge.
 ns=            0
 dc   -1.852103699114891     
 dc   -1.852103699114891       -0.2739970931617439      
    1.257978962626695     
 after etotal
 after hairpin
 after secondary
 refstr=  T
CG processor   0 is finishing work.
Warning: ieee_invalid is signaling
Warning: ieee_denorm is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_underflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
OK: absdiff= 0, ene= -146.009100