A chance encounter at IDRC 2014 led to a desire to produce a joint Mythbuster column on the issues surrounding “peak assignment”. The regular column authors are here joined by Phil Williams.
Get full access to this article
View all access options for this article.
References
1.
WorkmanJ.Jr and WeyerL., Practical Guide to Interpretive Near-infrared Spectroscopy. CRC Press, Boca Raton, FL (2008).
2.
ColthupN.B.DalyL.H. and WiberleyS.E., Introduction to Infrared and Raman Spectroscopy, 2nd Edn.Academic Press, New York (1975).
HöskuldssonA., Prediction Methods in Science and Technology, Vol. 1. Basic Theory. Thor Publishing, Denmark (1996). ISBN 87-985941-0-9.
5.
EsbensenK.H. and GeladiP., “Principles of proper validation: Use and abuse of re-sampling for validation”, J. Chemometr.24, 168–187 (2010). doi: http://dx.doi.org/10.1002/cem.1310