Data toolkits for processing NMR, MALDI MSI, MALDI single cell, Raman Spectroscopy, LC-MS and GC-MS raw data, chemoinformatics data analysis and data visualization.

An R package for preprocessing and Multivariate Analysis of Two-dimensional Gas Chromatography Data

Algorithm for aligning GCxGC chromatograms

Algorithm to delineate and remove the signal baseline from a GCxGC chromatogram

Algorithm to estimate partitioning properties of nonpolar compounds based on GCxGC retention times

Algorithm for creating Mass Loss Tables from chemical samples analyzed by GCxGC

Concawe's GCxGC-Elution-Model

An R code for classifying GCxGC data based on a NMF algorithm