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Updated: Jun 1, 2025

Author Spotlight: Advancing Cell Membrane Biophysics - Exploring Interactions and Challenges Through Experimental and Computational Approaches
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Author Spotlight: Advancing Cell Membrane Biophysics - Exploring Interactions and Challenges Through Experimental and Computational Approaches

Published on: September 1, 2023

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应用现代人工智能技术在开发有机分子力场中的应用

Junmin Chen1,2, Qian Gao1, Miaofei Huang1

  • 1Institute of Materials Research (IMR), Tsinghua Shenzhen International Graduate School, Tsinghua University, Shenzhen, 518055, China. yu.kuang@sz.tsinghua.edu.cn.

Physical chemistry chemical physics : PCCP
|January 17, 2025
PubMed
概括

人工智能 (AI) 正在对有机分子的分子动力学 (MD) 力场 (FFs) 进行革命. 人工智能增强了FF的开发,尽管面临当前的挑战,但它承诺对分子设计进行更准确的模拟.

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