Re: [bug #14941] Final Run error message -- December 14, 2009 - 18:05

Hi,

I've found the problem and fixed this bug.  It only occurs if the
local_tm global model is selected and as this doesn't happen often,
not many people are affected.  You can try out the new code by
checking it out directly from the repository.  To do this, just follow
the instructions for example in my response to Raj Jose at
https://mail.gna.org/public/relax-users/2009-02/msg00020.html.

Cheers,

Edward


2009/12/14 anonymous <NO-REPLY.INVALID-ADDRESS@xxxxxxx>:
> URL:
>  <http://gna.org/bugs/?14941>
>
>                 Summary: Final Run error message
>                 Project: relax
>            Submitted by: None
>            Submitted on: Monday 12/14/2009 at 16:57 CET
>                Category: None
>                Severity: 3 - Normal
>                Priority: 5 - Normal
>                  Status: None
>                 Privacy: Public
>             Assigned to: None
>         Originator Name:
>        Originator Email: mikaela.stewart@xxxxxxxxx
>             Open/Closed: Open
>         Discussion Lock: Any
>                 Release: 1.3.3
>        Operating System: GNU/Linux
>
>    _______________________________________________________
>
> Details:
>
> I originally reported this under support not realizing it was a bug.  I am
> running relax using the full_analysis.py script and after running all of the
> models until they converged I tried to run "final" to pick the best model 
> and
> do monte-carlo simulations and I get the following traceback...
>
> relax> monte_carlo.setup(number=200)
>
> relax> monte_carlo.create_data(method='back_calc')
> Traceback (most recent call last):
>  File "/usr/local/bin/relax", line 418, in ?
>    Relax()
>  File "/usr/local/bin/relax", line 127, in __init__
>    self.interpreter.run(self.script_file)
>  File "/usr/local/relax-1.3.3/relax-1.3/prompt/interpreter.py", line 273, in
> run
>    elif hasattr(self.relax, 'dummy_mode'):
>  File "/usr/local/relax-1.3.3/relax-1.3/prompt/interpreter.py", line 534, in
> run_script
>    def runcode(self, code):
>  File "/usr/local/relax-1.3.3/relax-1.3/prompt/interpreter.py", line 430, in
> interact_script
>    except KeyboardInterrupt:
>  File "full_analysis_test.py", line 668, in ?
>    Main(self.relax)
>  File "full_analysis_test.py", line 368, in __init__
>    monte_carlo.create_data()
>  File "/usr/local/relax-1.3.3/relax-1.3/prompt/monte_carlo.py", line 91, in
> create_data
>    monte_carlo.create_data(method=method)
>  File "/usr/local/relax-1.3.3/relax-1.3/generic_fns/monte_carlo.py", line
> 76, in create_data
>    data = create_mc_data(data_index)
>  File "/usr/local/relax-1.3.3/relax-1.3/specific_fns/model_free/main.py",
> line 508, in create_mc_data
>    valid_types = ['mf_orig', 'mf_ext', 'mf_ext2']
>  File
> "/usr/local/relax-1.3.3/relax-1.3/specific_fns/model_free/mf_minimise.py",
> line 61, in back_calc
>    value = self.minimise(min_algor='back_calc', min_options=(index,
> ri_label, frq_label, frq))
>  File
> "/usr/local/relax-1.3.3/relax-1.3/specific_fns/model_free/mf_minimise.py",
> line 773, in minimise
>    if not spin.model:
> AttributeError: 'SpinContainer' object has no attribute 'model'
>
>
>
> I am attaching my results files for "local_tm/aic" and "sphere/opt" in that
> order.  I still get the error message if I run the script using only these
> two files. Thank you very much for your help with this.
>
>
>
>    _______________________________________________________
>
> File Attachments:
>
>
> -------------------------------------------------------
> Date: Monday 12/14/2009 at 16:57 CET  Name: results.bz2  Size: 8kB   By: 
> None
>
> <http://gna.org/bugs/download.php?file_id=7499>
> -------------------------------------------------------
> Date: Monday 12/14/2009 at 16:57 CET  Name: results.bz2  Size: 18kB   By:
> None
>
> <http://gna.org/bugs/download.php?file_id=7500>
>
>    _______________________________________________________
>
> Reply to this item at:
>
>  <http://gna.org/bugs/?14941>
>
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