[CSC 335] Finding TMS based off of baseline
Andrew J. Pounds
pounds_aj at mercer.edu
Tue Oct 19 08:33:50 EDT 2021
The "baseline" is will be provided in the input file. In the handout
for the project it is called "baseline adjustment". Generally after an
NMR operator completes a spectrum he is presented with the raw data on
the screen. The first thing he does is then use the keyboard our mouse
to place the baseline above the noise prior to the analysis. In your
case, the location of the data point comes in as part of the nmr.in file.
On 10/18/21 8:50 PM, wrote:
> Dr. Pounds,
>
> For the project when we're finding the TMS for the dataset from what I
> understand we are searching for the rightmost "significant" peak which
> would be the rightmost peak that is greater than the baseline. My
> question is how we meant are to determine what the baseline should be
> given a dataset.
>
> Thanks,
>
>
--
Andrew J. Pounds, Ph.D. (pounds_aj at mercer.edu)
Professor of Chemistry and Computer Science
Director of the Computational Science Program
Mercer University, Macon, GA 31207 (478) 301-5627
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