Preprint
Machine Learning

Artificial intelligence: A powerful paradigm for scientific research

Yongjun Xu(Chinese Academy of Sciences), Xin Liu(Chinese Academy of Sciences), Xin Cao(Shanghai Medical College of Fudan University), Changping Huang(Chinese Academy of Sciences), Enke Liu(Chinese Academy of Sciences), Sen Qian(Chinese Academy of Sciences), Xingchen Liu(Chinese Academy of Sciences), Yanjun Wu(Chinese Academy of Sciences), Fengliang Dong(National Center for Nanoscience and Technology), Cheng‐Wei Qiu(National University of Singapore), Junjun Qiu(Shanghai Medical College of Fudan University), Keqin Hua(Shanghai Medical College of Fudan University), Wentao Su(Dalian Polytechnic University), Jian Wu(Second Affiliated Hospital of Zhejiang University), Huiyu Xu(Peking University Third Hospital), Yong Han(Zhejiang Provincial People's Hospital), Chenguang Fu(Zhejiang University), Zhigang Yin(Chinese Academy of Sciences), Miao Liu(Chinese Academy of Sciences), Ronald Roepman(Radboud University Nijmegen), Sabine Dietmann(Washington University in St. Louis), Marko Virta(University of Helsinki), Fredrick Orori Kengara(Bomet University), Ze Zhang(Shihezi University), Lifu Zhang(Shihezi University), Taolan Zhao(Chinese Academy of Sciences), Ji Dai(Chinese Academy of Sciences), Jialiang Yang, Liang Lan(Hong Kong Baptist University), Ming Luo(Chinese Academy of Sciences), Zhaofeng Liu(Chinese Academy of Sciences), Tao An(Chinese Academy of Sciences), Bin Zhang(Chinese Academy of Sciences), Xiao Bing He(Chinese Academy of Sciences), Shan Cong(Chinese Academy of Sciences), Xiaohong Liu(Chinese Academy of Sciences), Wei Zhang(Chinese Academy of Sciences), James P. Lewis(Chinese Academy of Sciences), James M. Tiedje(Michigan State University), Qi Wang(Chinese Academy of Sciences), Zhulin An(Chinese Academy of Sciences), Fei Wang(Chinese Academy of Sciences), Libo Zhang(Shihezi University), Tao Huang(Chinese Academy of Sciences), Chuan Lü(Aberystwyth University), Zhipeng Cai(Georgia State University), Wang Fang(Chinese Academy of Sciences), Jiabao Zhang(Chinese Academy of Sciences)
October 28, 2021The Innovation1,720 citations

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Influential Citations

The Innovation

Venue

2021

Year

Abstract

Artificial intelligence (AI) coupled with promising machine learning (ML) techniques well known from computer science is broadly affecting many aspects of various fields including science and technology, industry, and even our day-to-day life. The ML techniques have been developed to analyze high-throughput data with a view to obtaining useful insights, categorizing, predicting, and making evidence-based decisions in novel ways, which will promote the growth of novel applications and fuel the sustainable booming of AI. This paper undertakes a comprehensive survey on the development and application of AI in different aspects of fundamental sciences, including information science, mathematics, medical science, materials science, geoscience, life science, physics, and chemistry. The challenges that each discipline of science meets, and the potentials of AI techniques to handle these challenges, are discussed in detail. Moreover, we shed light on new research trends entailing the integration of AI into each scientific discipline. The aim of this paper is to provide a broad research guideline on fundamental sciences with potential infusion of AI, to help motivate researchers to deeply understand the state-of-the-art applications of AI-based fundamental sciences, and thereby to help promote the continuous development of these fundamental sciences.

Analysis

Why This Paper Matters

Artificial intelligence (AI) and machine learning (ML) are transforming scientific research across disciplines. This paper, published in The Innovation in 2021, provides a timely and comprehensive survey of how AI is being applied to fundamental sciences, including information science, mathematics, medical science, materials science, geoscience, life science, physics, and chemistry. With over 1,700 citations, it has become a key reference for researchers seeking to understand the intersection of AI and scientific discovery.

The paper matters because it bridges the gap between computer science and domain sciences. It not only catalogues existing applications but also discusses discipline-specific challenges and the potential of AI to address them. By highlighting new research trends, it offers a roadmap for future work, encouraging cross-disciplinary collaboration. In an era where data-driven science is becoming the norm, this survey provides a valuable overview for both AI practitioners and domain scientists.

Moreover, the paper emphasizes the role of ML in analyzing high-throughput data, categorizing, predicting, and making evidence-based decisions. This aligns with the growing trend of AI as a powerful paradigm for scientific research, capable of accelerating discovery and innovation. The broad coverage makes it an essential read for anyone interested in the application of AI beyond traditional computer science domains.

Technical Contributions

  • Comprehensive Survey: The paper systematically reviews AI/ML applications across eight fundamental science disciplines, providing a structured overview of techniques and use cases.
  • Challenge Identification: For each discipline, it identifies specific challenges that AI can help overcome, such as data complexity, high dimensionality, and pattern recognition.
  • Trend Analysis: It sheds light on emerging research trends, including the integration of AI into scientific workflows and the development of novel AI-based methodologies.
  • Research Guideline: The authors aim to provide a broad guideline for researchers, helping them understand state-of-the-art applications and motivate further exploration.
  • Cross-Disciplinary Perspective: By covering multiple fields, the paper facilitates knowledge transfer and highlights common AI techniques that can be adapted across domains.

Results

As a survey paper, it does not present new experimental results or metrics. Instead, it synthesizes findings from existing literature, offering qualitative insights into the state of AI in fundamental sciences. The paper discusses various case studies and applications, but does not provide quantitative comparisons or benchmarks. Its value lies in its comprehensive coverage and the identification of trends and challenges, rather than in empirical validation.

Significance

The significance of this paper lies in its role as a foundational reference for the integration of AI into scientific research. By mapping the landscape of AI applications across disciplines, it helps researchers identify opportunities and challenges, fostering cross-disciplinary innovation. The paper's high citation count (over 1,700) attests to its impact and utility in the community. It has likely inspired numerous research projects and collaborations, contributing to the accelerated adoption of AI in various scientific fields. Furthermore, it underscores the transformative potential of AI as a general-purpose technology for science, paving the way for future breakthroughs in data-driven discovery.