Hi Maddy,

This looks like a clear bug!  Would you like to submit a bug report
about this?  That would help in tracking it down.  The submission can
be done at https://gna.org/bugs/?func=additem&group=relax.

Cheers,

Edward



On 23 August 2011 18:23, Maddy Strickland <[email protected]> wrote:
> Hello,
>
> I've been trying to use the new 1.3.11, skipping straight from 1.3.9.
> I've been having trouble with the dauvergne_protocol.py script.  The
> program doesn't seem to recognise this script like 1.3.9 does.  The error
> comes after reading the sequence, so I assume it must be when reading the
> data files (NOE/R1/R2 etc.).  I think it's something to do with the fact
> that 'RELAX_DATA' hasn't been updated in the same way as
> 'relax_data.read'.  It's getting 'ri_label' rather than the 'ri_id' it's
> expecting?  Is there a way of formatting this script that solves this
> problem?  I've tried loads of different ways.
>
> Maddy
>
> ------------------------------
> None       2033       HIS        None       N
> None       2034       HIS        None       N
> None       2035       HIS        None       N
> None       2036       HIS        None       N
> None       2037       HIS        None       N
> None       2038       HIS        None       N
> Traceback (most recent call last):
>  File "/usr/local/bin/relax", line 7, in <module>
>    relax.start()
>  File "/usr/local/relax/relax.py", line 80, in start
>    Relax(mode)
>  File "/usr/local/relax/relax.py", line 149, in __init__
>    self.interpreter.run(self.script_file)
>  File "/usr/local/relax/prompt/interpreter.py", line 297, in run
>    return run_script(intro=self.__intro_string, local=locals(),
> script_file=script_file, quit=self.__quit_flag,
> show_script=self.__show_script,
> raise_relax_error=self.__raise_relax_error)
>  File "/usr/local/relax/prompt/interpreter.py", line 606, in run_script
>    return console.interact(intro, local, script_file, quit,
> show_script=show_script, raise_relax_error=raise_relax_error)
>  File "/usr/local/relax/prompt/interpreter.py", line 492, in interact_script
>    exec_script(script_file, local)
>  File "/usr/local/relax/prompt/interpreter.py", line 380, in exec_script
>    runpy.run_module(module, globals)
>  File "/usr/local/lib/python2.6/runpy.py", line 140, in run_module
>    fname, loader, pkg_name)
>  File "/usr/local/lib/python2.6/runpy.py", line 34, in _run_code
>    exec code in run_globals
>  File
> "/home/ms4225/nmr_data/IGF2R/dynamics/relax/chicken/FINALC_110823_relax11/full_analysis_localtm.py",
> line 199, in <module>
>    dAuvergne_protocol(diff_model=DIFF_MODEL, mf_models=MF_MODELS,
> local_tm_models=LOCAL_TM_MODELS, pdb_file=PDB_FILE, seq_args=SEQ_ARGS,
> het_name=HET_NAME, attached_name=ATTACHED_NAME, relax_data=RELAX_DATA,
> unres=UNRES, exclude=EXCLUDE, bond_length=BOND_LENGTH, csa=CSA,
> hetnuc=HETNUC, proton=PROTON, grid_inc=GRID_INC, min_algor=MIN_ALGOR,
> mc_num=MC_NUM, conv_loop=CONV_LOOP)
>  File "/usr/local/relax/auto_analyses/dauvergne_protocol.py", line 228,
> in __init__
>    self.execute()
>  File "/usr/local/relax/auto_analyses/dauvergne_protocol.py", line 556,
> in execute
>    self.multi_model(local_tm=True)
>  File "/usr/local/relax/auto_analyses/dauvergne_protocol.py", line 821,
> in multi_model
>    self.interpreter.relax_data.read(ri_label=data[0], frq_label=data[1],
> frq=data[2], file=data[3], dir=data[4], mol_name_col=data[5],
> res_num_col=data[6], res_name_col=data[7], spin_num_col=data[8],
> spin_name_col=data[9], data_col=data[10], error_col=data[11],
> sep=data[12])
> TypeError: read() got an unexpected keyword argument 'ri_label'
> [ms4225@amber FINALC_110823_relax11]$
>
>
> Madeleine Strickland
>
> MCJC Group
> N317, School of Chemistry, Bristol University
>
>
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