Data readiness pipeline patterns for scientific AI at scale: Insights from climate, fusion, life sciences, and materials

IF 3.5 4区 计算机科学 Q3 COMPUTER SCIENCE, ARTIFICIAL INTELLIGENCE
Ai Magazine Pub Date : 2026-03-07 DOI:10.1002/aaai.70056
Wesley Brewer, Patrick Widener, Valentine Anantharaj, Feiyi Wang, Tom Beck, Arjun Shankar, Sarp Oral
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引用次数: 0

Abstract

This article examines how data readiness for AI principles apply to large scientific datasets used to train foundation models. We analyze archetypal workflows across four representative domains—climate, nuclear fusion, life sciences, and materials—to identify common preprocessing patterns and domain-specific constraints. We introduce a two-dimensional readiness model that combines canonical preprocessing patterns with a five-level operational readiness scale, both tailored to high-performance computing (HPC) environments. This construct helps outline key challenges in transforming large-scale scientific data into formats suitable for scalable AI training. Together, these dimensions form a conceptual maturity matrix that characterizes scientific data readiness and guides infrastructure development toward standardized, cross-domain support for scalable and reproducible AI for science. Finally, we evaluate this maturity matrix in the context of case studies including ClimaX (climate), AFLOW (materials), OpenFold (proteomics), and DIII-D fusion disruption-prediction workflows, from which we distill lessons learned and provide recommendations to guide practitioners in developing robust AI-readiness pipelines. Finally, we discuss remaining cross-cutting challenges that persist across scientific domains.

Abstract Image

大规模科学人工智能的数据准备管道模式:来自气候、融合、生命科学和材料的见解
本文探讨了人工智能原理的数据准备如何应用于用于训练基础模型的大型科学数据集。我们分析了四个代表性领域(气候、核聚变、生命科学和材料)的原型工作流,以确定常见的预处理模式和领域特定的约束。我们引入了一个二维准备模型,该模型结合了规范的预处理模式和五级操作准备规模,两者都是为高性能计算(HPC)环境量身定制的。这种结构有助于概述将大规模科学数据转换为适合可扩展人工智能训练的格式的关键挑战。这些维度共同构成了一个概念成熟度矩阵,该矩阵表征了科学数据的准备情况,并指导基础设施开发朝着标准化、跨领域支持可扩展和可重复的科学人工智能发展。最后,我们在案例研究的背景下评估这个成熟度矩阵,包括ClimaX(气候)、AFLOW(材料)、OpenFold(蛋白质组学)和DIII-D融合中断预测工作流程,从中我们提炼出经验教训,并提供建议,指导从业者开发强大的人工智能准备管道。最后,我们讨论了跨科学领域仍然存在的跨领域挑战。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
Ai Magazine
Ai Magazine 工程技术-计算机:人工智能
CiteScore
3.90
自引率
11.10%
发文量
61
审稿时长
>12 weeks
期刊介绍: AI Magazine publishes original articles that are reasonably self-contained and aimed at a broad spectrum of the AI community. Technical content should be kept to a minimum. In general, the magazine does not publish articles that have been published elsewhere in whole or in part. The magazine welcomes the contribution of articles on the theory and practice of AI as well as general survey articles, tutorial articles on timely topics, conference or symposia or workshop reports, and timely columns on topics of interest to AI scientists.
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