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I've got some (phased) 2D spectra and I'd like to create an automated workflow to get a listing of the peak positions, intensities and possibly the relaxation times (though I don't care so much about that last thing). It seems like there are a lot of programs that can do this, but I mostly work in Matlab, and whatever I use would have to be imported into Matlab anyway, so I'd really prefer if there were either some Matlab scripts available somewhere or an algorithm that I could implement. |
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you might find something useful here: matnmr.sourceforge.net/ ''' Description: MatNMR is a highly flexible toolbox for processing 1D and 2D NMR/EPR spectra in MATLAB and creating high-quality 1D, 2D or 3D plots. Fully GUI and/or script-based. ''' goodluck in addition: one other nice thing that I like about MatNMR is that sometimes I can't find how to do exactly what I want in the GUI, but when I load the fid/spectrum data using MatNMR, while the MatNMR GUI is running, you can shift back to Matlab and get all the (raw)data in very good organized way. - Amin os (Apr 13 '12 at 05:00) |
