Multi-method ensemble selection of spectral bands related to leaf biochemistry

Multi-method ensembles are generally believed to return more reliable results than the application of one method alone. Here, we test if for the quantification of leaf traits an ensemble of regression models, consisting of Partial Least Squares (PLSR), Random Forest (RFR), and Support Vector Machine regression (SVMR) models, is able to improve the robustness of the spectral band selection process compared to the outcome of a single technique alone. The ensemble approach was tested using one artificial and five measured data sets of leaf level spectra and corresponding information on leaf chlorophyll, dry matter, and water content. PLSR models optimized for the goodness of fit, an established approach for band selection, were used to evaluate the performance of the ensemble. Although the fits of the models within the ensemble were poorer than the fits achieved with the reference approach, the ensemble was able to provide a band selection with higher consistency across all data sets. Due to the selection characteristics of the methods within the ensemble, the ensemble selection is moderately narrow and restrictive but in good agreement with known absorption features published in literature. We conclude that analyzing the range of agreement of different model types is an efficient way to select a robust set of spectral bands related to the foliar properties under investigation. This may help to deepen our understanding of the spectral response of biochemical and biophysical traits in foliage and canopies.