Make sure not to miss Rhyan Barrett and Michael talking about #ML for ground, excited states and inverse design at the #cecam #psik workshop in Berlin! So glad to follow all the amazing talks online.😍thanks for the great organization Michele Ceriotti Cecilia Clementi & more

📢 Hi #compchem and #ML community. I have an open PhD position I seek to fill as soon as possible. The focus is on ML for organic photocatalysis (NNs and exp. design). If you know of sb who might be interested, please encourage them to get in touch. Thanks for passing this along.

Check out my first first author paper with Julia Westermayr introducing an actor-critic reinforcement learning framework for targeting molecules with desirable properties :): pubs.acs.org/doi/10.1021/ac… #ChemistryAI #ML #CompChem UNIVERSITÄT LEIPZIG ¹²³H (RTG 2721)

Check out the Letter from Rhyan Barrett & Julia Westermayr introducing an actor-critic reinforcement learning framework for targeting molecules w/desirable properties, used to predict minimum energy pathways for key reactions. UNIVERSITÄT LEIPZIG ¹²³H (RTG 2721) go.acs.org/8eG

Yesterday, I had the chance to present my first spotlight poster at #MoML2024 at Mila - Institut québécois d'IA AI Institute! I presented joint work done with Luisa Kärmer and our amazing advisors, Julia Westermayr and Jens Meiler Lab. Huge thanks to @Esporascicomm for the amazing graphic design work!