SCS Symposium on AI 2024
«Critical Use of AI in Quantum Chemistry»
25. November 2024, University of Fribourg
SCS Seminar on AI 2024
«Critical use of AI in Quantum Chemistry»
25. November 2024, University of Fribourg
SCS Symposium on AI 2024
«Critical Use of AI in Quantum Chemistry»
25. November 2024, University of Fribourg
SCS Seminar on AI 2024
«Critical use of AI in Quantum Chemistry»
25. November 2024, University of Fribourg
09.00
Welcome Coffee
09.30
Opening and Welcome Message by Prof. Stefan Vučković
09.45
Prof. Sereina Riniker, ETH Zurich
«Learning physical interactions for molecular dynamics simulations»
10.25
Dr. Ruben Laplaza, EPFL Lausanne
«Navigating homogeneous catalyst landscapes»
11.05
Short Break
11.25
2 Contributed Talks à 15 min
11.55
Dr. Zoe Cournia, Biomedical Research Foundation Academy of Athens
«Predicting protein-ligand, protein-protein and protein-membrane interactions using molecular simulations and AI»
12.35
Lunch Break / Poster Session
14.00
Prof. Alexandre Thatchenko, University of Luxembourg
«Towards AI-enabled Fully Quantum (Bio)Molecular Simulations»
14.40
Dr. Elias Polak, University of Fribourg
«Real-space machine learning of correlation density functionals»
15.20
Short Break
15.40
Prof. Jeremy Richardson, ETH Zurich
«Machine-learning acceleration for semiclassical and nonadiabatic dynamics»
16.20
Prof. Markus Meuwly, University of Basel
«Constructing, Validating and Using Machine-Learned Potential Energy Surfaces»
17.10
Closing Word
17.15
Aperitif