mailRe: [bug #18019] Gridsearch appears not to be working when upper/lower bounds are set


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Posted by Edward d'Auvergne on April 12, 2011 - 08:51:
Hi,

Is there any reason this bug report has been made private?  The data
is so truncated, there's nothing much anyone can do with it.  The
privacy tag is usually reserved for security issues whereby it needs
to be kept private until a fix is found and released.  Then the bug
can be made public.  I'm looking into this now, but I'm not exactly
sure what is happening.  Is it ok if I include this data, or part of
it, into the relax test suite?  This will significantly help in the
debugging and will make sure this bug never returns!

Cheers,

Edward



On 11 April 2011 13:42, anonymous <NO-REPLY.INVALID-ADDRESS@xxxxxxx> wrote:

URL:
 <http://gna.org/bugs/?18019>

                Summary: Gridsearch appears not to be working when
upper/lower bounds are set
                Project: relax
           Submitted by: None
           Submitted on: Mon 11 Apr 2011 11:42:49 AM UTC
               Category: relax's source code
               Severity: 3 - Normal
               Priority: 5 - Normal
                 Status: None
                Privacy: Private
            Assigned to: None
        Originator Name: Tiago Pais
       Originator Email: tpais@xxxxxxxxxxx
            Open/Closed: Open
        Discussion Lock: Any
                Release: 1.3.8
       Operating System: GNU/Linux

   _______________________________________________________

Details:

My system is Ubuntu-9.04:
When I perform a gridsearch, exclusively for m5, with the lower and upper
bounds set to: lower=[0.111, 0, -0.0], upper=[0.111, 1.00, 200] I keep 
seeing
the following message during the calculations:



"Min f:              3474.82



k: 3860     xk: [       0.111,    0.066667,          -0] fk: nan


Increment:          array([ 5, 16, 16])

Params:             array([ 0.111,  1.   ,    Inf])

Min params:         array([ 0.111     ,  0.06666667, -0.        ])

f:                  nan



Min f:              3474.82



k: 3861     xk: [       0.111,    0.066667,          -0] fk: nan


Increment:          array([ 6, 16, 16])

Params:             array([ 0.111,  1.   ,    Inf])

Min params:         array([ 0.111     ,  0.06666667, -0.        ])

f:                  nan

"

And at the end the tauS is zero for all spins and the S2s is always close to
1.

Attached follows the script that I am using and a truncated sample of my 
data
set (I hope it is not too truncated!) as well as the results that I am
getting.

If you need more info let me know.
Thanks
Regards
Tiago P



   _______________________________________________________

File Attachments:


-------------------------------------------------------
Date: Mon 11 Apr 2011 11:42:49 AM UTC  Name: ErrorReportRelax.tar.gz  Size:
8kB   By: None

<http://gna.org/bugs/download.php?file_id=12833>

   _______________________________________________________

Reply to this item at:

 <http://gna.org/bugs/?18019>

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