Nam Ki Hyun
Department of Life Science, Pohang University of Science and Technology, Pohang 37673, Korea.
Int J Mol Sci. 2021 Apr 5;22(7):3761. doi: 10.3390/ijms22073761.
All molecular systems, from small molecules to macromolecules, exhibit specific characteristics for a specific environment and time. In order to gain an accurate understanding of the functions of all types of molecules, studies of their structure and dynamics are essential. Through dynamic studies, using techniques such as spectroscopy, structure determination, and computer analysis, it is possible to collect functional information on molecules at specific times and in specific environments. Such information not only reveals the properties and mechanisms of action of molecules but also provides insights that can be applied to various industries, such as the development of new materials and drugs. Herein, I discuss the importance of molecular dynamics studies, present the time scale of molecular motion, and review techniques for analyzing molecular dynamics.
所有分子系统，从小分子到大分子，在特定的环境和时间内都表现出特定的特征。为了准确理解各类分子的功能，对其结构和动力学进行研究至关重要。通过动态研究，利用光谱学、结构测定和计算机分析等技术，可以在特定时间和特定环境下收集分子的功能信息。这些信息不仅揭示了分子的性质和作用机制，还提供了可应用于各种行业的见解，如新材料和药物的开发。在此，我将讨论分子动力学研究的重要性，介绍分子运动的时间尺度，并回顾分析分子动力学的技术。
