<![CDATA[Multiwfn forum / Plot the H_NMR spectrum from a .txt file (I have difficulties)]]> //www.umsyar.com/wfnbbs/viewtopic.php?id=1798 The most recent posts in Plot the H_NMR spectrum from a .txt file (I have difficulties). Sun, 22 Feb 2026 22:15:20 +0000 FluxBB <![CDATA[Re: Plot the H_NMR spectrum from a .txt file (I have difficulties)]]> //www.umsyar.com/wfnbbs/viewtopic.php?pid=5594#p5594

Hello,

Multiwfn can export NMR curve data as NMR_curve.txt, which is a two-column text X-Y file, you can directly import it into e.g. Origin, or directly using gnuplot/qtgrace to plot it as a curve map.

Yes.

dummy@example.com (sobereva) Sun, 22 Feb 2026 22:15:20 +0000 //www.umsyar.com/wfnbbs/viewtopic.php?pid=5594#p5594
<![CDATA[Plot the H_NMR spectrum from a .txt file (I have difficulties)]]> //www.umsyar.com/wfnbbs/viewtopic.php?pid=5593#p5593

I am working with the graphical function offered by MULTIWFN software. I can obtain the PNG or PDF image without any problem, but I need a file to import into Origin or LibreOffice Calc. The software generates three files: NMRdata, NMRcurve, and NMRline. I tried importing each of them, but none produce a plot.
Also I have another doubt. The manual says: 10 Average shielding values of specific atoms: For example, usually the of the hydrogens in the same methyl group should be averaged, you can use this function to realize this purpose.
So, I must assign the equivalent protons manually? 


Can you help me? Kind regards from Brazil.

dummy@example.com (lc-chemist) Sun, 22 Feb 2026 19:23:02 +0000 //www.umsyar.com/wfnbbs/viewtopic.php?pid=5593#p5593
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