Recent Developments in Integrated Molecular Design
With Stephane Redon
In recent years, SAMSON has emerged as a popular platform for molecular design, offering an integrated environment for scientists to model, simulate, and analyze complex molecular systems. This talk will provide a look at the latest developments in the platform, focusing on three advancements: the extension of the data model for coarse-grained systems, new tools for Python development, and the introduction of SAMSON AI, a large language model (LLM)-based assistant. Regarding the challenge (one of them): Bridge the gap between virtual design and experimentation.