arXiv AI By Haiqian Yang, Markus J. Buehler

Prospector: learning a compact graph traversal policy for scientific reasoning

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Prospector is a compact model that learns to traverse a domain knowledge graph step by step, calling a small set of tools to build context and produce a chain of evidence that can be verified against the graph. Trained on a semiconductor‑manufacturing knowledge graph, it matches or surpasses off‑the‑shelf models that use the same graph and tools, and it also transfers to unseen graphs in bio‑inspired materials, PFAS, and materials properties. Running on a single GPU, Prospector is faster and cheaper than hosted services while keeping proprietary data on the owner’s hardware.

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arXiv Computation and Language
Sep 3

HyGRAIL: Cost-Aware and Evidence-Grounded Scientific Hypothesis Discovery over Knowledge Graphs

HyGRAIL is a framework for discovering scientific hypotheses in incomplete knowledge graphs by combining a graph neural network (GNN) triage with large language model (LLM) review. The GNN scores candidate hypotheses and routes only ambiguous cases to the LLM, which receives structured evidence from the graph converted into natural language. Experiments on MatKG show HyGRAIL achieves the highest F1 score, improves over baselines, and cuts LLM calls by over 54%.

By Yihang Sun, Zhihan Zhu, Zhiyuan Jiang, Jingyi Ge, Zixuan Li, Jiaxuan You