Hi Andras,
I was wondering if you were interested in helping out with the
inversion-recovery task at https://gna.org/task/index.php?7415 ? What
is your input data format, i.e. which peak list format are you using?
Would it be possible to create synthetic peak lists containing with a
single spin system whereby you have calculated what the peak
intensities are based on your equation and some I0 and Rx parameter
values? If this could be done, it could be added to the relax test
suite directories and form the basis of an implementation. It could
easily then be used to create a system test which checks that the
fitting occurs as expected. Then implementing this should be easy.
Cheers,
Edward
On 26 November 2014 at 16:59, Andras Boeszoermenyi
<NO-REPLY.INVALID-ADDRESS@xxxxxxx> wrote:
URL:
<http://gna.org/support/?3195>
Summary: Fitting of saturation recovery experiment
Project: relax
Submitted by: andras
Submitted on: Wed 26 Nov 2014 03:59:50 PM UTC
Category: Feature request
Priority: 5 - Normal
Severity: 3 - Normal
Status: None
Assigned to: None
Originator Email:
Open/Closed: Open
Discussion Lock: Any
Operating System: Mac OS
_______________________________________________________
Details:
Hi,
would it be possible to add an option to fit saturation recovery experiments
to the existing 'exp' and 'inv' options in relax_fit?
The formula should look like this:
I(t) = I0*(1 - exp(−R1*t))
Best regards,
Andras Boeszoermenyi
_______________________________________________________
Reply to this item at:
<http://gna.org/support/?3195>
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Re: [sr #3195] Fitting of saturation recovery experiment