How can one steer generative flow models (e.g., for geometric molecular design) not via explicit hand-designed reward functions but implicitly via high-level discovery goals expressed in natural language? LFD provides an approach to do so along with scientific case studies.
We’re bringing natural-language control to any scientific generator.
We are very excited to introduce LLM-to-Flow Distillation (LFD), a method to adapt scientific generators to high-level natural-language discovery goals.
Starting from textual goals like “design peptides with promising anticancer activity” or “design small molecules binding to the D2 dopamine receptor”, LFD distills high-level goal-related knowledge from LLMs into scientific generators through iterative DPO on LLM-generated sub-goals.
🔥 LFD does not need task-specific proxy rewards, works with any frontier LLM via API-access, and outperforms state-of-the-art reward-guided methods such as FlowGRPO and DiffusionNFT on held-out computational evaluations. (1/6)View quoted post on X
