[bug #7875] Script full_analysis.py shoots error when starting monte carlo simulations for the final run -- November 28, 2006 - 20:49

URL:
  <http://gna.org/bugs/?7875>

                 Summary: Script full_analysis.py shoots error when starting
monte carlo simulations for the final run
                 Project: relax
            Submitted by: semor
            Submitted on: Tuesday 11/28/2006 at 19:49
                Category: relax's source code
                Severity: 4 - Important
                Priority: 5 - Normal
                  Status: None
                 Privacy: Public
             Assigned to: None
         Originator Name: 
        Originator Email: 
             Open/Closed: Open
         Discussion Lock: Any
                 Release: Repository: 1.2 line
        Operating System: GNU/Linux

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Details:

At revision 2890...

Using the full_analysis.py script for the final optimization, I get the
following error :

========================================================

The model from the run 'local_tm' has been selected.

relax> monte_carlo.setup(run='final', number=200)

relax> monte_carlo.create_data(run='final', method='back_calc')
Traceback (most recent call last):
  File "/home/semor/bin/relax", line 454, in ?
    Relax()
  File "/home/semor/bin/relax", line 166, in __init__
    self.interpreter.run()
  File "/2home/packages/relax/prompt/interpreter.py", line 213, in run
    run_script(intro=self.relax.intro_string, local=self.local,
script_file=self.relax.script_file, quit=1)
  File "/2home/packages/relax/prompt/interpreter.py", line 388, in
run_script
    console.interact(intro, local, script_file, quit)
  File "/2home/packages/relax/prompt/interpreter.py", line 340, in
interact_script
    execfile(script_file, local)
  File "./full_analysis_SEMOR_FINAL_200_auto_check.py", line 566, in ?
    Main(self.relax)
  File "./full_analysis_SEMOR_FINAL_200_auto_check.py", line 296, in
__init__
    monte_carlo.create_data('final')
  File "/2home/packages/relax/prompt/monte_carlo.py", line 91, in
create_data
    self.__relax__.generic.monte_carlo.create_data(run=run, method=method)
  File "/2home/packages/relax/generic_fns/monte_carlo.py", line 78, in
create_data
    data = create_mc_data(self.run, i)
  File "/2home/packages/relax/specific_fns/model_free.py", line 640, in
create_mc_data
    value = self.back_calc(run=run, index=i,
ri_label=self.relax.data.res[run][i].ri_labels[j],
frq_label=self.relax.data.res[run][i].frq_labels[self.relax.data.res[run][i].remap_table[j]],
frq=self.relax.data.res[run][i].frq[self.relax.data.res[run][i].remap_table[j]])
  File "/2home/packages/relax/specific_fns/model_free.py", line 399, in
back_calc
    value = self.minimise(run=self.run, min_algor='back_calc',
min_options=(index, ri_label, frq_label, frq))
  File "/2home/packages/relax/specific_fns/model_free.py", line 2025, in
minimise
    if not self.relax.data.res[self.run][i].model:
AttributeError: Element instance has no attribute 'model'






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