12.75s
Test: UNRES_MD_microcanonical
(Passed)
Build: homology Linux-ifort-MPI E0LL2Y
(dell15)
on 2018-08-27 04:04:24
Repository revision: 6f95af5d4a04ea311fb1e784ce812f133dc8f2e5
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 1
nodes 2 rank 0
Processor 0 out of 2 rank in CG_COMM 0
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
size of CG_COMM 1 size of FG_COMM 2 rank in FG_COMM1
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
ns= 0
Processor 1 1 1 ivec_start 11 ivec_end
21
MPI: node= 0 iseed= -3059742
indpdb= 0 pdbref= T
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 12.6690599918365 sec
Processor 0 BROADCAST time 0.180455207824707 REDUCE time
0.881598949432373 GATHER time 0.000000000000000E+000 SCATTER time
8.433461189270020E-002 SENDRECV 0.000000000000000E+000 BARRIER ene
0.393488645553589 order[ 1 ] 0.134126186370850 order[
2 ] 0.000000000000000E+000 order[ 3 ]
9.024786949157715E-002 BARRIER grad 0.138754844665527
CG processor 0 is finishing work.
0.000000000000000E+000 order[ 4 ] 1.09824490547180 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 0.529279470443726 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 74.2696
standard deviation 0.00323915
average total energy 74.2696
standard deviation 0.00323915