12.14s
Test: UNRES_MD_microcanonical
(Passed)
Build: homology Linux-ifort-MPI E0LL2Y
(dell15)
on 2018-07-04 04:07:37
Repository revision: 4a5964cdc6b84e3073a4155bf997640cf45b6993
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
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 thetname_pdb
/tmp/cdash/homology/source/PARAM/thetaml.5parm
thetname_pdb
/tmp/cdash/homology/source/PARAM/thetaml.5parm
51 opened
51 opened
MPI: node= 0 iseed= -3059742
ns= 0
Processor 1 1 1 ivec_start 11 ivec_end
21
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 12.0415911674500 sec
Processor 0 BROADCAST time 0.122391462326050 REDUCE time
0.612506866455078 GATHER time 0.000000000000000E+000 SCATTER time
6.792259216308594E-002 SENDRECV 0.000000000000000E+000 BARRIER ene
7.025265693664551E-002 BARRIER grad 8.986473083496094E-002
CG processor 0 is finishing work.
0.372312545776367 order[ 1 ] 8.812355995178223E-002 order[
2 ] 0.000000000000000E+000 order[ 3 ]
0.000000000000000E+000 order[ 4 ] 1.05173158645630 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 0.351265668869019 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