15.83s
Test: UNRES_M_MD_microcanonical
(Failed)
Build: homology Linux-ifort-MPI E0LL2Y
(dell15)
on 2017-09-29 23:17:12
Repository revision: 61e3ac7683f0bf1b86acf2fe81ea2a7e3f9f9c0f
Show Command Line/users/local/mpich2-1.4.1p1_intel/bin/mpiexec "-np" "2" "/tmp/cdash/homology/build/source/unres/src_MD-M/test_prota_E0LL2Y.sh" "1l2y_micro" "2"
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Show Failing/Passing Graph
Test outputCTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
MPI: node= 0 iseed= -3059742
indpdb= 0 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ]
Total wall clock time 15.7770879268646 sec
Processor 0 BROADCAST time 0.177488327026367 REDUCE time
1.29779744148254 GATHER time 0.000000000000000E+000 SCATTER time
9.424948692321777E-002 SENDRECV 0.000000000000000E+000 BARRIER ene
9.866833686828613E-002 BARRIER grad 0.149677991867065
CG processor 0 is finishing work.
0.461910486221313 order[ 1 ] 0.141630411148071 order[
2 ] 0.000000000000000E+000 order[ 3 ]
0.000000000000000E+000 order[ 4 ] 1.16376686096191 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 0.414180994033813 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
Bye Bye...
Bye Bye...
average total energy 74.6458
standard deviation 0.526547
average total energy 74.6458
standard deviation 0.526547
difference 37.1188 from reference ave etot 37.527 greater than 5.0
difference 37.1188 from reference ave etot 37.527 greater than 5.0