Recursive feature elimination in Raman spectra with support vector machines

in: Frontiers of Optoelectronics (2017)
Kampe, Bernd; Kloß, Sandra; Bocklitz, Thomas W.; Rösch, Petra; Popp, Jürgen
The presence of irrelevant and correlated data points in a Raman spectrum can lead to a decline in classifier performance. We introduce support vector machine-based recursive feature elimination into the field of Raman spectroscopy and demonstrate its performance on a dataset of spectra of clinically relevant microorganisms in urine samples, along with patient samples. As the original technique is only suitable for two-class problems, we adapt it to the multi-class setting. It is shown that a large amount of spectral points can be removed without degrading the prediction accuracy of the resulting model notably.

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