Evaluating performance of SORS-based subsurface signal separation methods using statistical replication Monte Carlo simulation

Abstract

Spatially offset Raman spectroscopy (SORS) is a depth-profiling technique with deep information enhancement. However, the interference of the surface layer cannot be eliminated without prior information. The signal separation method is an effective candidate for reconstructing pure subsurface Raman spectra, and there is still a lack of evaluation means for the signal separation method. Therefore, a method based on line-scan SORS combined with improved statistical replication Monte Carlo (SRMC) simulation was proposed to evaluate the effectiveness of food subsurface signal separation method. Firstly, SRMC simulates the photon flux in the sample, generates a corresponding number of Raman photons at each voxel of interest, and collects them by external map scanning. Then, 5625 groups of mixed signals with different optical characteristic parameters were convoluted with spectra of public database and application measurement and introduced into signal separation methods. The effectiveness and application range of the method were evaluated by the similarity between the separated signals and the source Raman spectra. Finally, the simulation results were verified by three packaged foods. FastICA method can effectively separate Raman signals from subsurface layer of food and thus promote deep quality evaluation of food.

Keywords: Monte Carlo; Packaged foods; SORS; Signal separation; Subsurface non-invasive evaluation.