This repository contains training data for retention time prediction for the identification of metabolites from non-targeted LC-MS based metabolomics. It is part of the collaborative project between Prof. Dr. Sebastian Böcker (Friedrich-Schiller-Universität Jena) and Dr. Michael Witting (Helmholtz Zentrum München) fundend by the DFG (Project Number 425789784)
The following people and resources contributed training data for this repository.
- Serge Rudaz, University of Geneva