The minisymposium was composed of four excellent talks:

• Gábor Csányi (University of Cambridge): The End of Ab Initio MD
• Felix Pultar (ETH Zurich): Enhancing Molecular Dynamics Simulations through Deep Learning
• Alexandre Tkatchenko (University of Luxembourg): Towards Fully Quantum (Bio)Molecular Modelling Enabled by HPC and ML: Dream or Reality?
• Julija Zavadlav (Technical University of Munich): Deep Coarse-Grained Molecular Modeling