分子模拟技术在食品组分互作体系及安全领域的应用研究进展

傅亮; 吕金羚; 张锦; 庄国栋; 朱勇; 陈永生

doi:10.12187/2023.02.001

April 2023

Article Contents

FU Liang, LYU Jinling, ZHANG Jin, et al. Research progress on the application of molecular simulation technology in food component interaction system and safety[J]. Journal of Light Industry, 2023, 38(2): 1-13. doi: 10.12187/2023.02.001

Citation: FU Liang, LYU Jinling, ZHANG Jin, et al. Research progress on the application of molecular simulation technology in food component interaction system and safety[J]. Journal of Light Industry, 2023, 38(2): 1-13. doi: 10.12187/2023.02.001 shu

Research progress on the application of molecular simulation technology in food component interaction system and safety

1. College of Science and Engineering, Jinan University, Guangzhou 510632, China;
2. School of Liquor and Food Engineering, Guizhou University, Guiyang 550025, China;
3. School of Traditional Chinese Medicine, Guangdong Pharmaceutical University, Guangzhou 511400, China

Received Date: 2022-05-23

Abstract

In the process of food processing and storage, there are complex interactions between components and molecules.Traditional test methods are difficult to clearly and intuitively explain the interaction mechanism affecting the nutritional value and safety of food from the molecular level. Molecular simulation technology is based on molecular model to study molecular behavior to predict or explain macroscopic experimental phenomena. It has the advantages of high efficiency and low cost, and is an important bridge between micro and macro scale. The application of this technology in food component interaction system was reviewed. It was considered that molecular simulation technology could reveal the molecular interaction mechanism of food nutrients, toxicological mechanism and bacteriostatic mechanism of food contaminants from the atomic/molecular level, characterize visual data such as dynamic changes of molecular conformation, electron transfer, covalent bond breakage and reconstruction, and provide guiding suggestions for practical production practices such as improving food processing and storage conditions and improving food safety. However, in recent years, there are some problems in the application of this technology, such as relatively independent and highly reactive molecules are considered as pure isolates or inert substances in the process of simulation. In the future, we should deeply study and gradually improve the relationship among conformational changes, functional properties and food quality of food component molecules induced by environment, in order to provide reference for the practical application of molecular simulation technology in different fields of food.
- molecular simulation technology,
- food component,
- interaction mechanism,
- food safety
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Research progress on the application of molecular simulation technology in food component interaction system and safety

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