Thanks for the help. It now works! However, I am having trouble with
the error values. The SDev for the noise in the spectra from nmrview
is 0.0. However, if I use the RMSD function in sparky to get noise
values, the errors on the plotted figures from relax are 4 orders of
magnitude bigger than the actual data. I know that the data is of
fairly high quality. What is the best method for estimating errors for
relax? Thanks.
----- Original Message -----
From: Sébastien Morin <sebastien.morin.1@xxxxxxxxx>
Date: Monday, May 25, 2009 12:30 pm
Subject: Re: [sr #2336] xpk files
To: anonymous <NO-REPLY.INVALID-ADDRESS@xxxxxxx>
Cc: ecino@xxxxxx, relax-devel@xxxxxxx
> Hi,
>
> 1.
> The function "spectrum.read_intensities()" is not available in
> relax-1.3.3. It is, however, available in the subversion
> repository
> where most up-to-date changes are located.
>
> 2.
> If you use relax-1.3.3, you will have to manually set the peak
> list
> format in the function "relax_fit.read()". For example:
> relax_fit.read(file='T2_ncyc1.list',
> format='nmrview',
> relax_time=0.0176)
>
> Let me know if things now work properly.
>
> Regards,
>
>
> Séb :)
>
>
>
> anonymous wrote:
> > Follow-up Comment #3, sr #2336 (project relax):
> >
> > I am using 1.3.3. I still have no clue how to get it to expect
> nmrview> opposed to sparky.
> >
> >
> _______________________________________________________>
> > Reply to this item at:
> >
> > <http://gna.org/support/?2336>
> >
> > _______________________________________________
> > Message sent via/by Gna!
> > http://gna.org/
> >
> >
> >
>
>
> --
> Sébastien Morin
> PhD Student
> S. Gagné NMR Laboratory
> Université Laval & PROTEO
> Québec, Canada
>
Elio Cino