Subject: Re: [nmr_sparky] integration
From: Stefano Ciurli
Date: Jun 4, 2010
Previous: 730
Tom,
Sparky does not have a routine to do linear interpolation of
spectrum data values.
OK!
I believe the correction to relaxbox.py I suggested are correct.
The equations are centering the ppm box at the peak position. The
parentheses were mis-placed in the original code so the box was not
centered.
of course your correction is fine! How did I dare saying that you are
wrong?! :-)
Thanks a lot!
Stefano
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