Friday, November 01 2024 18:34:04
UNRES
40.51s| Temperature distribution 1L2Y_L | File /tmp/cdash/build/source/unres/src_MD/1L2Y_L_GB000.stat.png not found |
|---|---|
| Processors | [Graph]1 |
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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/source/PARAM/thetaml.5parm
51 opened
thetname_pdb
/tmp/cdash/source/PARAM/thetaml.5parm
51 opened
MPI: node= 0 iseed= -3059742
indpdb= 0 pdbref= T
Call Read_Bridge.
ns= 0
Processor 0 0 0 ivec_start 1 ivec_end
10
ns= 0
Processor 1 1 1 ivec_start 11 ivec_end
21
Total wall clock time 40.4480881690979 sec
Processor 0 BROADCAST time 0.440383195877075 REDUCE time
4.61924076080322 GATHER time 0.000000000000000E+000 SCATTER time
0.792497158050537 SENDRECV 0.000000000000000E+000 BARRIER ene
2.38097119331360 BARRIER grad 0.560103893280029
CG processor 0 is finishing work.
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ]
0.000000000000000E+000 order[ 1 ] 0.543893098831177 order[
2 ] 0.837170839309692 order[ 3 ]
1.07413172721863 order[ 4 ] 6.64789867401123 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 0.370306968688965 order[
8 ] 0.000000000000000E+000 order[ 9 ]
1.79448843002319 order[ 10 ] 1.060962677001953E-004
Traceback (most recent call last):
File "./matplotlib_fit_hist.py", line 3, in <module>
import matplotlib
ImportError: No module named matplotlib
Chi2 for fitting theoretical temperature distribution
(standard_in) 1: syntax error
./prota_unres_energy_check.sh: line 83: [: !=: unary operator expected
