FastRet

Authors Tobias Schmidt, Christian Amesoeder, Marian Schoen

Last update 17 December 2025

Copyright license GNU General Public License, version 3.0

Software version identifier 1.1.3, 1.1.4, PACKAGES.rds, 1.3.0

Description

A framework for predicting retention times in liquid chromatography. Users can train custom models for specific chromatography columns, predict retention times using existing models, or adjust existing models to account for altered experimental conditions. The provided functionalities can be accessed either via the R console or via a graphical user interface. Related work: Bonini et al. (2020) <doi:10.1021/acs.analchem.9b05765>.

Cites work

Retip: Retention Time Prediction for Compound Annotation in Untargeted Metabolomics

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