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A Machine Learning Application for Classification of Chemical Spectra
(2008)
This paper presents a software package that allows chemists to analyze spectroscopy data using innovative machine learning (ML) techniques. The package, designed for use in conjunction with lab-based spectroscopic ...
The Effect of Principal Component Analysis on Machine Learning Accuracy with High Dimensional Spectral Data
(2005)
The classi¿cation of high dimensional data, such as images, gene-expression data and spectral data, poses an interesting challenge to machine learning, as the presence of high numbers of redundant or highly correlated ...
Qualitative and Quantitative Analysis of Chlorinated Solvents using Raman Spectroscopy and Machine Learning
(2005)
The unambiguous identification and quantification of hazardous materials is of increasing importance in many sectors such as waste disposal, pharmaceutical manufacturing, and environmental protection. One particular ...