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by Emilien
Wed Apr 24, 2024 6:00 am
Forum: General forum
Topic: erpload from Magnettech
Replies: 0
Views: 19

erpload from Magnettech

Hello, I'd like to use the eprload function to plot kinetic recored with a Magnettech spectrometer. The kinetic mode generates a directory containing single spectra. In the magnettech software (ESRstudio), the results can be saved with 3 different extensions: xml (new format), spe (old format), or c...
by Emilien
Wed Jan 10, 2024 9:18 am
Forum: EasySpin file exchange
Topic: SimLabel: a GUI to simulate cw EPR from spin labeling
Replies: 62
Views: 460217

Re: SimLabel: a GUI to simulate cw EPR from spin labeling

Hi,
you are right. Your application is unfortunately not covered by SimLabel...
However you can do it by coding. You can also use the cwEPR App of Leonard Obrien if you already know EasySpin.
And sorry for the delay of answer, my subcription to this post has been surprisingly unchecked.

Emilien

by Emilien
Wed Feb 01, 2023 1:33 am
Forum: EasySpin file exchange
Topic: SimLabel: a GUI to simulate cw EPR from spin labeling
Replies: 62
Views: 460217

Re: SimLabel: a GUI to simulate cw EPR from spin labeling

NEW!!!!!

Guidelines for the simulations of Nitroxide X-band cw EPR spectra from SDSL experiments are now available!

Etienne at al, 2023, Molecules 2023, 28(3), 1348 (https://doi.org/10.3390/molecules28031348)

by Emilien
Fri Sep 23, 2022 7:52 am
Forum: EasySpin file exchange
Topic: SimLabel: a GUI to simulate cw EPR from spin labeling
Replies: 62
Views: 460217

Re: SimLabel: a GUI to simulate cw EPR from spin labeling

An updated version is available * ! Just replace the previous files... SimLabel_Sept2022.zip What's new: hyperfine coupling values always given in mT, but values in MHz given in the tooltip, only 4 digits for g values / sliders steps adapted, splitting measurement available on spectra (see documenta...
by Emilien
Fri Sep 10, 2021 2:48 am
Forum: EasySpin file exchange
Topic: SimLabel: a GUI to simulate cw EPR from spin labeling
Replies: 62
Views: 460217

Re: SimLabel: a GUI to simulate cw EPR from spin labeling

Hello every one, I forget to comment a few lines in the last release. Before the next version, to avoid error when starting fitting or going back from fitting, just search the following lines and comment them! the concerned lines: set (hzoomin,'enable','off'); set (hzoomout,'enable','off'); set (hha...
by Emilien
Thu Jul 15, 2021 7:55 am
Forum: EasySpin file exchange
Topic: SimLabel: a GUI to simulate cw EPR from spin labeling
Replies: 62
Views: 460217

Re: SimLabel: a GUI to simulate cw EPR from spin labeling

An updated version is available * ! Just replace the previous files... SimLabel_Jul2021.zip What's new: *.spe files from Magnettech can now be loaded, Easyspin conversion tool is run when "?" is clicked, instead of previous rigid scale, The tools zoom in, zoom out and pan are no more displ...
by Emilien
Mon Apr 26, 2021 3:12 am
Forum: EasySpin file exchange
Topic: SimLabel: a GUI to simulate cw EPR from spin labeling
Replies: 62
Views: 460217

Re: SimLabel: a GUI to simulate cw EPR from spin labeling

I actually did not try the 2020b Matlab release...
You can try to comment the lines 333 to 342. It should work...

by Emilien
Sun Apr 25, 2021 11:18 pm
Forum: EasySpin file exchange
Topic: SimLabel: a GUI to simulate cw EPR from spin labeling
Replies: 62
Views: 460217

Re: SimLabel: a GUI to simulate cw EPR from spin labeling

Hello,
what is the matlab release you are using?
Are you sure you are using the SimLabel sept2020 release?
Emilien

by Emilien
Tue Apr 06, 2021 7:18 am
Forum: General forum
Topic: S=2 simulations
Replies: 7
Views: 6719

Re: S=2 simulations

The strain is modeled by a gaussian distribution both in ES and in the paper. The only difference is how is characterized this gaussian distribution. FWHM is used in ES. Standard deviation is used in the paper (FWHM=2.sigma.(2.ln(2)) 0.5 =2.3548.sigma). Then I replace the corresponding line in the f...
by Emilien
Wed Mar 31, 2021 1:30 am
Forum: General forum
Topic: S=2 simulations
Replies: 7
Views: 6719

Re: S=2 simulations

I have an experimental spectra that looks like the one in the figure 5.
Unfortunately easyspin seems not to be able to simulate this spectra... whatever the parameters are...
Moreover, I found some simulated spectra in the litterature. I can not imagine that they all are wrong...

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