24.99s
Test: UNRES_M_MD_microcanonical
(Failed)
Build: homology Linux-gfortan-MPI E0LL2Y
(dell15)
on 2017-12-03 03:25:11
Repository revision: 2e4664425cf99771a8d398073b3c546df52e111b
Show Command Line/users/local/mpich2-1.4.1p1_gnu/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
Total wall clock time 24.941704988479614 sec
Processor 0 BROADCAST time 0.18268585205078125 REDUCE time 1.2296965122222900 GATHER time 0.0000000000000000 SCATTER time 0.10765242576599121 SENDRECV 0.0000000000000000 BARRIER ene 9.9558830261230469E-002 BARRIER grad 0.12564420700073242
CG processor 0 is finishing work.
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ] 0.49115920066833496 order[ 1 ] 0.12199211120605469 order[ 2 ] 0.0000000000000000 order[ 3 ] 0.0000000000000000 order[ 4 ] 2.2572748661041260 order[ 5 ] 0.0000000000000000 order[ 6 ] 0.0000000000000000 order[ 7 ] 0.44891166687011719 order[ 8 ] 2.3413773178767426E-310 order[ 9 ] 2.0595683258875225E-316 order[ 10 ] 6.9531485072614465E-310
STOP Bye Bye...
STOP Bye Bye...
average total energy 74.3154
standard deviation 0.0598498
average total energy 74.3154
standard deviation 0.0598498
difference 36.7884 from reference ave etot 37.527 greater than 5.0
difference 36.7884 from reference ave etot 37.527 greater than 5.0