Molecular interactions are at the core of all biological processes. Understanding the complexity of these interactions has wide-reaching implications across the life sciences, from agriculture and food science to animal science and human health. The Professorship of Chemoinformatics and Protein Modelling focuses on modeling and simulating molecular interactions, offering novel insights into key biological questions across these fields. The research group evaluates, benchmarks, and customizes emerging computational tools to investigate the structure and dynamics of molecular targets, while also developing methods for efficient and rapid virtual screening campaigns. A key focus lies in G protein-coupled receptors and taste/odorant systems to advance scientific and translational applications in the food and medical areas.