3 papers
cs.AI2026
How to Spend Your Oracle Budget: Practical Guidance for Protein Structure Prediction Models
Aleksandra Kalisz, Jack Simons, Krisztina Sinkovics +4
Foundation models for protein structure prediction remain unreliable on certain targets. External oracles can flag and correct these failures, but biological oracles are expensive,…
stat.ML2025
Sample-Efficient Optimisation over the Outputs of Generative Models
Samuel Willis, Paul Duckworth, Jack Simons +10
Modern generative AI models, such as diffusion and flow matching models, can sample from rich data distributions. However, many applications, especially in science and engineering,…
stat.ML2023
Minimizing -Divergences by Interpolating Velocity Fields
Song Liu, Jiahao Yu, Jack Simons +2
Many machine learning problems can be seen as approximating a \textit{target} distribution using a \textit{particle} distribution by minimizing their statistical discrepancy. Wasse…