University Chemistry ›› 2025, Vol. 40 ›› Issue (1): 75-81.doi: 10.12461/PKU.DXHX202411061

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A Brief Introduction to Nobel Prize in Chemistry 2024: Deciphering the Mysteries of Protein Structures by Computational Modelling and Artificial Intelligence

Fengzhang Wang1, Yuan Liu1, Chu Wang1,2   

  1. 1 College of Chemistry and Molecular Engineering, Peking University, Beijing 100871, China;
    2 Peking-Tsinghua Center for Life Sciences, Academy for Advanced Interdisciplinary Studies, Peking University, Beijing 100871, China
  • Received:2024-11-19 Accepted:2024-12-04 Published:2025-01-06
  • Contact: Chu Wang E-mail:chuwang@pku.edu.cn

Abstract: Proteins play major roles in all life activities, and the three-dimensional (3D) structures of proteins are closely related to their biological functions. In 2024, half of the Nobel Prize in Chemistry was awarded to Dr. Demis Hassabis and Dr. John Jumper from DeepMind, for their breakthrough contributions to protein structure prediction. The other half was awarded to Prof. David Baker from the University of Washington, for his systematic research in computational protein design. Here, we briefly review the research milestones of protein structure prediction and design, and prospect their cutting-edge applications.

Key words: Nobel Prize in Chemistry, Protein folding, Protein structure prediction, Computational protein design, Rosetta, AlphaFold