Philippe Schwaller

Philippe Schwaller is a Tenure Track Assistant Professor at École Polytechnique Fédérale de Lausanne (EPFL), School of Basic Sciences, within the Institute of Chemical Sciences and Engineering. He leads the Laboratory of Artificial Chemical Intelligence (LIAC), a research group focused on leveraging artificial intelligence to accelerate molecular discovery and sustainable chemistry. He is also a core Principal Investigator of the NCCR Catalysis, a national Swiss research center.

His research lies at the intersection of chemistry, materials science, and computer science, with a strong emphasis on developing machine learning models for molecular design and synthesis. LIAC's work is driven by real-world sustainability challenges, aiming to reduce the time and cost of discovering new functional molecules and materials.

The recent publications and projects from his lab highlight a strong trend in generative AI for chemistry, including memory-augmented models, hypergraph neural networks, and large language models tailored for scientific discovery. These efforts are complemented by educational initiatives such as the 'AI for Chemistry' course and practical programming resources for chemists.

He actively supervises a diverse group of PhD students and contributes to multiple doctoral programs at EPFL, including EDCH and EDPY. His teaching portfolio includes courses on computational chemistry, AI applications in chemistry, and scientific machine learning.

Philippe Schwaller is deeply involved in advancing AI-driven scientific discovery through both research and education, positioning his lab at the forefront of artificial chemical intelligence. The lab maintains active open-source contributions on GitHub, fostering collaboration and transparency in scientific AI development.