Pyromics: source code for data processing
Abstract
This repository contains the core processing code implemented in Python from the Pyromics software. It includes functions for smoothing via Gaussian and moving average filters, baseline correction using assymetric least sqaures (AsLS) and polynomial fitting, and similarity matching through dot product, Euclidean distance squared, and weighted cosine methods. Also has Correlation Optimized Warping (COW) for sample alignment and a Multivariate Curve Resolution Alternating Least Squares (MCR-ALS) based deconvolution logic.
Fields of Study & Subjects
Spectroscopy and Chemometric Analyses
Metabolomics and Mass Spectrometry Studies
Spectroscopy Techniques in Biomedical and Chemical Research
Publication details
- Journal / source
- Zenodo (CERN European Organization for Nuclear Research)
- Publication date
- 11 February 2026
- Language
- EN
- Document type
- Book