Minisymposium

MS3F - Accelerating Sustainable Development through Coupled HPC Simulations and AI

Minisymposium Presentation

MLDocking: Accelerated Drug Discovery with Transformer-Based Surrogate Models and In-Memory Workflows on Heterogeneous HPC Systems

Minisymposium Presentation

MLDocking: Accelerated Drug Discovery with Transformer-Based Surrogate Models and In-Memory Workflows on Heterogeneous HPC Systems