18.66s
Test: UNRES_MD_microcanonical
(Passed)
Build: Linux-gfortan-MPI E0LL2Y
(dell15)
on 2023-07-15 03:06:17
Repository revision: cfd3f3ea9ccac7a6b9cb0e802b4c9e5927a506f6
Show Command Line/users/local/mpich2-1.4.1p1_gnu/bin/mpiexec "-np" "2" "/tmp/cdash/build/source/unres/src_MD/test_prota_E0LL2Y.sh" "1l2y_micro" "2"
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Show Failing/Passing Graph
Test outputCTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
Processor 0 out of 2 rank in CG_COMM 0 size of CG_COMM 1 size of FG_COMM 2 rank in FG_COMM1 0 size of FG_COMM1 2
Processor 1 out of 2 rank in FG_COMM 1 size of FG_COMM 2 rank in FG_COMM1 1 size of FG_COMM1 2
Inside initializeInside initialize MPI: node= 0 iseed= -3059742
indpdb= 0 pdbref= T
Call Read_Bridge.
ns= 0
Processor 0 0 0 ivec_start 1 ivec_end 10
ns= 0
Processor 1 1 1 ivec_start 11 ivec_end 21
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 18.589920043945312 sec
Processor 0 BROADCAST time 0.14067173004150391 REDUCE time 0.68517398834228516 GATHER time 0.0000000000000000 SCATTER time 7.9927206039428711E-002 SENDRECV 0.0000000000000000 BARRIER ene 0.12945437431335449 BARRIER grad 9.3324899673461914E-002
CG processor 0 is finishing work.
Processor 1 wait times for respective orders order[ 0 ] 0.36403560638427734 order[ 1 ] 9.4920635223388672E-002 order[ 2 ] 0.0000000000000000 order[ 3 ] 0.0000000000000000 order[ 4 ] 2.1550514698028564 order[ 5 ] 6.9529671141828613E-310 order[ 6 ] 2.3241147409848983E-310 order[ 7 ] 0.39865231513977051 order[ 8 ] 6.9529671141820708E-310 order[ 9 ] 6.9529671141844423E-310 order[ 10 ] 0.0000000000000000
STOP Bye Bye...
STOP Bye Bye...
average total energy 74.3377
standard deviation 0.047301
average total energy 74.3377
standard deviation 0.047301