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Paper · arXiv

From Scientific Observations to Mechanisms: Benchmarking Hypothesis Generation by AI Scientists

Data-driven mechanistic hypotheses are essential to scientific discovery because they explain how underlying processes produce observed phenomena. AI agents and AI scientists increasingly support scientific data analysis. However, their ability to turn empirical findings into mechanistic hypotheses remains insufficiently examined. To address this gap, we introduce MechHypoBench, the first benchmark for evaluating whether AI agents and AI scientists can generate such hypotheses from empirical data. It combines paper-derived mechanisms from 14 scientific fields with real-world datasets containing 17.98 million records. The construction retains the observational complexity of empirical data ...

AuthorsXiaxun Xie, Qingqing Long, Meng Xiao et al.
Primary categorycs.AI
Published4 October 2026
Last updated at source4 October 2026
cs.AI
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