Environmental Cheminformatics

Code related to Talavera Andujar et al DOI: 10.26434/chemrxiv-2023-6j2gm

An R package for generating chemical stripes from patent or literature data extracted from PubChem

A repository for the non-target analysis of Luxembourg surface water samples led by Dagny Aurich

Configuration of the teaching system.

Utilities that work with GNPS records.

A repository to track files needed for the Integrated Systems Biology (ISB401) Master's course.

Repository for NORMAN-SLE work organization at ECI, including list tracking, updates and documentation. Main representatives: Emma and Hiba.

PubChem PFAS

Educational platform for ISB401 course.

A project for interactions with PubChem

A home for documentation, scripts etc related to PubChem efforts

Treating compound mixes

Pre-screening mass spectrometry data.