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Paper · arXiv

Initialization Improves LLM-Driven Discovery

Large Language Models (LLMs) have been used for novel discovery of algorithms, theorems, drugs, and other tasks through the use of harnesses that prompt an LLM to iteratively optimize an objective. In this work, we study the relationship between the population of previous iterates and eventual discovery success. We generalize past work on harness design to develop a suite of 12 harnesses called 'Modular' and characterize their performance across 5 diverse discovery tasks, finding that discovery success is brittle and sensitive to harness design. We uncover mode collapse, characterized by a dramatic drop in the diversity of iterates, as a common failure mode. We find that popular state-of-...

AuthorsMansi Sakarvadia, Marco Ciccone, Colin Raffel
Primary categorycs.LG
Published30 September 2026
Last updated at source30 September 2026
cs.LGcs.AIcs.CL
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