Dear relax team,
I am currently trying to carry out a fully automated model free calculation
in the relax gui with R1, R2 and hnOE at two fields - all of which were
calculated in relax. The calculation ends with what I think are sensible
results but also generates the error below (including debugging). This
occurred in relax 2.1.2 and still occurs, exactly the same, in relax 2.2.2.
The error says that I should submit a bug report, but I thought I would ask
here first for any advice or clues as to what is going wrong.
Many thanks,
James.
debug> Observer: 'auto_analyses' notifying the 'controller' method
update_controller().
debug> Execution lock: Release by 'mf (Fri Feb 15 12:07:59 2013)'
('auto-analysis' mode).
debug> Observer: 'exec_lock' notifying the 'controller' method
update_gauge().
debug> Observer: 'exec_lock' notifying the 'gui' method enab().
debug> Observer: 'exec_lock' notifying the 'mf (Fri Feb 15 12:07:59 2013)'
method activate().
Exception raised in thread.
Traceback (most recent call last):
File "/SOFTWARE/relax/relax-2.2.2/gui/analyses/execute.py", line 87, in
run
self.run_analysis()
File "/SOFTWARE/relax/relax-2.2.2/gui/analyses/auto_model_free.py", line
808, in run_analysis
dauvergne_protocol.dAuvergne_protocol(pipe_name=self.data.pipe_name,
pipe_bundle=self.data.pipe_bundle, results_dir=self.data.save_dir,
diff_model=self.data.global_models, mf_models=self.data.mf_models,
local_tm_models=self.data.local_tm_models, grid_inc=self.data.inc,
diff_tensor_grid_inc=self.data.diff_tensor_grid_inc,
mc_sim_num=self.data.mc_sim_num, max_iter=self.data.max_iter,
conv_loop=self.data.conv_loop)
File "/SOFTWARE/relax/relax-2.2.2/auto_analyses/dauvergne_protocol.py",
line 234, in __init__
self.execute()
File "/SOFTWARE/relax/relax-2.2.2/auto_analyses/dauvergne_protocol.py",
line 745, in execute
self.write_results()
File "/SOFTWARE/relax/relax-2.2.2/auto_analyses/dauvergne_protocol.py",
line 911, in write_results
self.interpreter.pymol.macro_write(data_type='amp_fast', dir=dir,
force=True)
File "/SOFTWARE/relax/relax-2.2.2/prompt/uf_objects.py", line 219, in
__call__
self._backend(*new_args, **uf_kargs)
File "/SOFTWARE/relax/relax-2.2.2/generic_fns/pymol_control.py", line
504, in macro_write
commands = create_macro(data_type=data_type, style=style,
colour_start=colour_start, colour_end=colour_end, colour_list=colour_list)
File "/SOFTWARE/relax/relax-2.2.2/generic_fns/pymol_control.py", line
358, in create_macro
commands = macro(data_type, style, colour_start, colour_end,
colour_list)
File "/SOFTWARE/relax/relax-2.2.2/specific_fns/model_free/macro_base.py",
line 499, in create_macro
self.classic_style(data_type, colour_start, colour_end, colour_list,
spin_id)
File "/SOFTWARE/relax/relax-2.2.2/specific_fns/model_free/macro_base.py",
line 179, in classic_style
raise RelaxFault
Storing the relax state in the file 'relax_state_20130216_160517.bz2'.
debug> Observer: 'gui_uf' registering the 'results viewer' method refresh().
debug> Observer: 'pipe_alteration' registering the 'results viewer' method
refresh().
debug> Observer: 'result_file' registering the 'results viewer' method
refresh().
debug> Observer: 'exec_lock' registering the 'results viewer' method
activate().
debug> Lock 'pipe_lock': Acquisition by 'results viewer window'.
debug> Lock 'pipe_lock': Release by 'results viewer window'.
RelaxFault: RelaxError: Impossible to be here, please re-run relax with the
'--debug' flag and summit a bug report at https://gna.org/projects/relax/.
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