PhD Position in Computational Chemistry and Machine Learning for Metalloenzymes University of Duisburg-Essen in Germany

PhD opening in Computational Chemistry at the Faculty of Chemistry, Institute for Physical Chemistry , University of Duisburg-Essen (Essen, Germany). The position is in the research group of Prof. Dr. Erna K. Wieduwilt and focuses on QM/MM calculations , metalloenzymes , machine learning , and the computational study of enzymatic reactions relevant to biomass and plastic degradation . The project is titled “Boosting Enzymatic Plastic Recycling via Future Computing” and is part of the NRW Return ...

INM-Leibniz Institute for New Materials is advertising PhD student positions in the Data-Driven Materials Design group led by Viktor Zaverkin . The research focuses on machine learning methods to model and design molecules and materials , making this a strong fit for applicants interested in materials science , computer science , and related interdisciplinary research. The positions are offered in collaboration with Universität des Saarlandes and the Deutsches Forschungszentrum für Künstliche In...

Paul Czodrowski at Johannes Gutenberg University Mainz is advertising one PhD vacancy in his group. The position is in structure-based drug design and is described as wet lab-heavy , with a strong emphasis on structural biology . The professor’s broader research profile includes artificial intelligence , drug discovery , and machine learning , which may be relevant to the group’s research environment. Applicants should have experience in structural biology and be ready to start a PhD in the grou...

Open PhD and Postdoc positions are available at the Max Planck Institute for Chemistry in Mainz, Germany, in the area of AI-driven molecular modeling for atmospheric organic reactions and multiphase/interfacial chemistry . The project is co-supervised by Prof. Yafang Cheng (Director, Aerosol Chemistry Department) and Dr. Huan Yang (Research Team Leader, Nanoscale Theory and Modeling). Research topics include autonomous reaction discovery using quantum chemistry, machine learning, and automation ...

A PhD position is open in the Kenmoe group at the Department of Theoretical Chemistry, Faculty of Chemistry, University of Duisburg-Essen . The project focuses on computer simulations of alcohol oxidation processes on oxide surfaces and collaboration with experimental groups within CRC/TRR 247 . This is a strong fit for candidates interested in theoretical chemistry , computational chemistry , physics , and materials science , especially electronic structure and condensed matter applications. Th...