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Chemometrics and near-infrared spectroscopy: Avoiding the pitfalls
Authors:Gary W.   
Affiliation:

aOptical Science and Technology Center & Department of Chemistry, University of Iowa, Iowa City, IA 52242, USA

Abstract:
The use of chemometrics in quantitative near-infrared (NIR) spectroscopy is reviewed from the standpoint of avoiding pitfalls that may lead to misleading or overly optimistic results. Using the NIR analysis of glucose in six-component mixture samples as an example, a set of guidelines is presented to help the analyst develop and implement a successful calibration.
Keywords:Glucose   Multivariate calibration   Near-infrared   NIR   Net analyte signal   Partial least-squares   PLS
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