Wednesday, September 18 2024 05:55:14
UNRES
51.46s| Temperature distribution 1L2Y_L | File /tmp/cdash/homology/build/source/unres/src_MD/1L2Y_L_GB000.stat.png not found |
|---|---|
| Processors | [Graph]1 |
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CTEST_FULL_OUTPUT
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
nodes 2 rank 1
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
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
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
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ] 9.8813129168249309E-324 order[ 1 ] 0.57224559783935547 order[ 2 ] 2.0775887966156006 order[ 3 ] 1.0818722248077393 order[ 4 ] 7.8039960861206055 order[ 5 ] 1.0133286396203967E-320 order[ 6 ] 0.0000000000000000 order[ 7 ] 0.37831068038940430 order[ 8 ] 0.0000000000000000 order[ 9 ] 1.9707913398742676 order[ 10 ] 1.1801719665527344E-004 order[ 11 ] 0.0000000000000000 order[ 12 ] 4.6792329278632192E-310
Total wall clock time 51.371399879455566 sec
Processor 0 BROADCAST time 0.49485564231872559 REDUCE time 4.8999290466308594 GATHER time 0.0000000000000000 SCATTER time 0.85505533218383789 SENDRECV 0.0000000000000000 BARRIER ene 2.0443408489227295 BARRIER grad 0.56540083885192871
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 83: [: !=: unary operator expected
