Thursday, July 04 2024 10:36:46
UNRES
40.47s| Temperature distribution 1L2Y_NH | File /tmp/cdash/homology/build/source/unres/src_MD/1L2Y_NH_GB000.stat.png not found |
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CTEST_FULL_OUTPUT
STOP Bye Bye...
STOP 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 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 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 40.405469894409180 sec
Processor 0 BROADCAST time 0.49850249290466309 REDUCE time 1.9949169158935547 GATHER time 0.0000000000000000 SCATTER time 0.24150180816650391 SENDRECV 0.0000000000000000 BARRIER ene 0.21585726737976074 BARRIER grad 0.32016634941101074
CG processor 0 is finishing work.
Processor 1 wait times for respective orders order[ 0 ] 0.90492558479309082 order[ 1 ] 0.28517794609069824 order[ 2 ] 0.0000000000000000 order[ 3 ] 0.0000000000000000 order[ 4 ] 4.4882462024688721 order[ 5 ] 0.0000000000000000 order[ 6 ] 0.0000000000000000 order[ 7 ] 1.9479384422302246 order[ 8 ] 0.0000000000000000 order[ 9 ] 0.0000000000000000 order[ 10 ] 0.0000000000000000 order[ 11 ] 6.9529407236387210E-310 order[ 12 ] 2.3535719058336883E-310
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 83: [: !=: unary operator expected
