46.67s
Test: UNRES_Berendsen
(Passed)
Build: homology Linux-ifort-MPI E0LL2Y
(dell15)
on 2024-03-18 04:00:33
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"
Show Test Time Graph
Show Failing/Passing Graph
Test outputCTEST_FULL_OUTPUT
Bye Bye...
Bye Bye...
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
thetname_pdb
/tmp/cdash/homology/source/PARAM/thetaml.5parm
51 opened
51 opened
MPI: node= 0 iseed= -3059742
indpdb= 0 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
Processor 1 1 1 ivec_start 11 ivec_end
21
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 46.5289399623871 sec
Processor 0 BROADCAST time 0.301442384719849 REDUCE time
0.000000000000000E+000 order[ 1 ] 0.447858095169067 order[
2 ] 2.35147118568420 order[ 3 ]
1.44151735305786 order[ 4 ] 4.25567913055420 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 8.55856347084045 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000 order[
11 ] 0.000000000000000E+000 order[ 12 ]
2.73186182975769 GATHER time 0.000000000000000E+000 SCATTER time
0.376942634582520 SENDRECV 0.000000000000000E+000 BARRIER ene
1.68280172348022 BARRIER grad 0.455422639846802
CG processor 0 is finishing work.
-7.397006569697029E-002
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