CDash : UNRES

0.86s
Test: UNRES_M_MIN_prota (Passed)
Build: homology Linux-gfortan-MPI E0LL2Y (m10) on 2024-10-23 03:27:08
Processors	[Graph]1
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Test output
CTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
   0.0000000000000000        0.0000000000000000     
          45          46          47
   1.9750000000000014       -2.0169999999999995     
          45          46          47
 -0.87200000000000000       -3.2160000000000002     
          45          46          47
   3.1690000000000000       0.43400000000000016     
 just before leave
   0.0000000000000000        0.0000000000000000     
           2           3           4
  0.91500000000000004       -1.5520000000000000     
           2           3           4
   3.3159999999999998        2.1159999999999997     
           2           3           4
  -1.5579999999999998        2.7590000000000003     
 just before leave
 ns=           0
 MPI: node=            0  iseed=              -3059742
 indpdb=          25  pdbref= T
   0.0000000000000000        0.0000000000000000     
          45          46          47
   1.9750000000000014       -2.0169999999999995     
          45          46          47
 -0.87200000000000000       -3.2160000000000002     
          45          46          47
   3.1690000000000000       0.43400000000000016     
 just before leave
   0.0000000000000000        0.0000000000000000     
           2           3           4
  0.91500000000000004       -1.5520000000000000     
           2           3           4
   3.3159999999999998        2.1159999999999997     
           2           3           4
  -1.5579999999999998        2.7590000000000003     
 just before leave
 Call Read_Bridge.
 ns=           0
 dc  -1.8521036991148909     
 dc  -1.8521036991148909      -0.27399709316174381        1.2579789626266946     
 after etotal
 after hairpin
 after secondary
 Calling MINIM_DC
 SUMSL return code is           4  eval         1023
 # eval/s   1716.3826579777615     
 refstr= T
 after hairpin
 after secondary
 Processor           1  CG group           0  absolute rank           1  leves ERGASTULUM.
 Total wall clock time  0.64136600494384766       sec
 Processor           0  BROADCAST time   1.2645721435546875E-003  REDUCE time   6.6874027252197266E-003  GATHER time   0.0000000000000000       SCATTER time   0.0000000000000000       SENDRECV   0.0000000000000000       BARRIER ene   7.5387954711914062E-004  BARRIER grad   5.7864189147949219E-004
CG processor   0 is finishing work.
 Processor           1  wait times for respective orders order[           0 ]   3.6828517913818359E-003  order[           1 ]   4.0598154067993164E-002  order[           2 ]   0.0000000000000000       order[           3 ]   0.0000000000000000       order[           4 ]   0.0000000000000000       order[           5 ]   0.0000000000000000       order[           6 ]   0.0000000000000000       order[           7 ]  0.17485451698303223       order[           8 ]   0.0000000000000000       order[           9 ]   0.0000000000000000       order[          10 ]   0.0000000000000000     
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO
STOP Bye Bye...
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
SUMSL return code 4
SUMSL return code 4
OK: absdiff= .075400, ene= -158.807500
OK: absdiff= .075400, ene= -158.807500