arXiv:2503.23170cs.AI2025-03被引 9

用多智能体AI从质谱数据中自动生成天体生物学新假说。

AstroAgents: A Multi-Agent AI for Hypothesis Generation from Mass Spectrometry Data

  • 八智能体协作解析质谱数据,分阶段处理与验证。
  • 从8个陨石和10份土壤样本中生成超百条假说,66%具新颖性。
  • 适合天体生物学研究者快速挖掘潜在生命信号线索。

随着太阳系采样返回任务的推进及质谱数据的日益丰富,亟需一种能结合现有天体生物学文献、从质谱数据中生成合理生命起源假说的方法。由于环境污染物干扰、光谱峰复杂以及与已有研究难以匹配等问题,该任务极具挑战。为此,我们提出 AstroAgents——一个基于大语言模型的多智能体系统,用于从质谱数据中生成假说。系统包含八个协作智能体:数据分析师、规划者、三位领域科学家、汇总者、文献评审员和批评者。系统接收质谱数据及用户提供的研究论文,由数据分析师解读数据,规划者将特定片段分配给科学家智能体深入探索,汇总者收集并去重生成的假说,文献评审员使用 Semantic Scholar 检索相关文献,批评者对假说进行严格评估并提出改进建议。为评估系统性能,一位天体生物学专家对来自8个陨石和10份土壤样本的百余条假说进行了新颖性和合理性评估,其中36%被认定为合理,而在这些合理假说中,66%具有新颖性。

原文摘要 · Abstract (English)

With upcoming sample return missions across the solar system and the increasing availability of mass spectrometry data, there is an urgent need for methods that analyze such data within the context of existing astrobiology literature and generate plausible hypotheses regarding the emergence of life on Earth. Hypothesis generation from mass spectrometry data is challenging due to factors such as environmental contaminants, the complexity of spectral peaks, and difficulties in cross-matching these peaks with prior studies. To address these challenges, we introduce AstroAgents, a large language model-based, multi-agent AI system for hypothesis generation from mass spectrometry data. AstroAgents is structured around eight collaborative agents: a data analyst, a planner, three domain scientists, an accumulator, a literature reviewer, and a critic. The system processes mass spectrometry data alongside user-provided research papers. The data analyst interprets the data, and the planner delegates specific segments to the scientist agents for in-depth exploration. The accumulator then collects and deduplicates the generated hypotheses, and the literature reviewer identifies relevant literature using Semantic Scholar. The critic evaluates the hypotheses, offering rigorous suggestions for improvement. To assess AstroAgents, an astrobiology expert evaluated the novelty and plausibility of more than a hundred hypotheses generated from data obtained from eight meteorites and ten soil samples. Of these hypotheses, 36% were identified as plausible, and among those, 66% were novel. Project website: https://astroagents.github.io/

多智能体质谱分析天体生物学假说生成

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