94.95s
Test: UNRES_Berendsen
(Passed)
Build: homology Linux-gfortan-MPI E0LL2Y
(dell15)
on 2023-12-09 03:25:05
Repository revision: e5301131661f6c05ad36e8aceadd77d37334772a
Temperature distribution 1L2Y_B | File /tmp/cdash/homology/build/source/unres/src_MD/1L2Y_B_GB000.stat.png not found |
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Show Command Line/bin/sh "/tmp/cdash/homology/build/source/unres/src_MD/test_mpi_E0LL2Y.sh" "1L2Y_B" "2" "2"
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Show Failing/Passing Graph
Test outputCTEST_FULL_OUTPUT
STOP Bye Bye...
STOP Bye Bye...
nodes 2 rank 0
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
Inside initialize nodes 2 rank 1
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 initialize 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.
Total wall clock time 94.749624013900757 sec
Processor 0 BROADCAST time 0.40672969818115234 REDUCE time 4.5395870208740234 GATHER time 0.0000000000000000 SCATTER time 0.59463119506835938 SENDRECV 0.0000000000000000 BARRIER ene 3.5134203433990479 BARRIER grad 0.53410792350769043
Processor 1 wait times for respective orders order[ 0 ] 0.0000000000000000 order[ 1 ] 0.55747652053833008 order[ 2 ] 3.8144936561584473 order[ 3 ] 2.1612489223480225 order[ 4 ] 13.956347942352295 order[ 5 ] 0.0000000000000000 order[ 6 ] 0.0000000000000000 order[ 7 ] 2.6232559680938721 order[ 8 ] 0.0000000000000000 order[ 9 ] 0.0000000000000000 order[ 10 ] 0.0000000000000000 order[ 11 ] 6.9529264195734614E-310 order[ 12 ] 2.3535316130964943E-310
CG processor 0 is finishing work.
File "./matplotlib_fit_hist.py", line 44
print '%15.10f' % chi_squared
^
SyntaxError: Missing parentheses in call to 'print'. Did you mean print('%15.10f' % chi_squared)?
Chi2 for fitting theoretical temperature distribution
(standard_in) 1: syntax error
./prota_unres_energy_check.sh: line 98: [: !=: unary operator expected