[CSC 335] Wednesday Class
Andrew J. Pounds
pounds_aj at mercer.edu
Tue Oct 24 13:52:53 EDT 2023
So now that the test is over we really need to start hammering on your
NMR project and differential equations. As far as the NMR project goes,
at this stage of the game you have seen all of the techniques you need
to complete the project. Assuming that your data is filtered and that
you can fit it to a cubic spline, the next hurdle is isolating the
beginning and ending points for integration. I would like to talk about
some ways you can test your code tomorrow and verify that you are doing
this properly. After that the only thing that remains is integrating the
peaks.
We will then finish off the differential equation chapter off on Friday
and talk about how to use gnuplot again. Your homework for chapter 5
is due the following Friday.
--
*Andrew J. Pounds, Ph.D.*
/Professor of Chemistry and Computer Science/
/Director of the Computational Science Program/
/Mercer University, Macon, GA, 31207 (478) 301-5627 /
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