12.62s
Test: UNRES_MD_microcanonical
(Passed)
Build: homology Linux-ifort-MPI E0LL2Y
(dell15)
on 2017-12-05 04:00:07
Repository revision: 2e4664425cf99771a8d398073b3c546df52e111b
Show Command Line/users/local/mpich2-1.4.1p1_intel/bin/mpiexec "-np" "2" "/tmp/cdash/homology/build/source/unres/src_MD/test_prota_E0LL2Y.sh" "1l2y_micro" "2"
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Test outputCTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
nodes 2 rank 0
nodes 2 rank 1
Processor 0 out of 2 rank in CG_COMM 0
size of CG_COMM 1 size of FG_COMM 2 rank in FG_COMM1
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
0 size of FG_COMM1 2
Inside initializeInside initialize thetname_pdb
/tmp/cdash/homology/source/PARAM/thetaml.5parm
51 opened
thetname_pdb
/tmp/cdash/homology/source/PARAM/thetaml.5parm
51 opened
MPI: node= 0 iseed= -3059742
indpdb= 0 pdbref= T
ns= 0
Processor 1 1 1 ivec_start 11 ivec_end
21
Call Read_Bridge.
ns= 0
Processor 0 0 0 ivec_start 1 ivec_end
10
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ]
Total wall clock time 12.5708248615265 sec
Processor 0 BROADCAST time 0.228194236755371 REDUCE time
0.878421068191528 GATHER time 0.000000000000000E+000 SCATTER time
0.479089021682739 order[ 1 ] 0.144219160079956 order[
2 ] 0.000000000000000E+000 order[ 3 ]
0.101837635040283 SENDRECV 0.000000000000000E+000 BARRIER ene
0.111426830291748 BARRIER grad 0.153577566146851
CG processor 0 is finishing work.
0.000000000000000E+000 order[ 4 ] 1.09771919250488 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 0.445235013961792 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000 order[
11 ] 0.000000000000000E+000 order[ 12 ]
0.000000000000000E+000
Bye Bye...
Bye Bye...
average total energy 74.2623
standard deviation 0.0221204
average total energy 74.2623
standard deviation 0.0221204
