cheminformatics
6 posts
Together with Nicolas Krauter, Bettina Derstroff, Christof Stönner, Efstratios Bourtsoukidis, Achim Edtbauer, Jochen Wulf, Thomas Klüpfel, Stefan Kramer, and Jonathan Williams, I won the Ig Nobel Prize in Chemistry for our work on the Smell of Fear. In the project, we used machine learning to try to better understand volatile […]
enviPath is both, a database and a prediction system, for the microbial biotransformation of organic environmental contaminants. The database provides the possibility to store and view experimentally observed biotransformation pathways, and supports annotating pathways with experimental and environmental conditions. The pathway prediction system provides different relative reasoning models to predict […]