关贸总协定的宗旨>周施雄
分子动力学模拟可以通过多款软件进行，根据需要不同可以选择不同的软件，但GROMACS是应用比较广泛的。生物大分子的结构动力学决定其生物学功能，而分子动力学模拟是研究其结构动力学的有效手段，因此采用GROMACS进行分子动力学计算分析从而指导进一步的实验工作。本文重点介绍了GROMACS的特点、基本流程以及制约因素等，并展望了未来的应用前景。无水硫铝酸钙
Abstract：Molecular dynamics simulation can be carried out through a variety of software， depending on the need to choose a different software， but GROMACS is widely used. biological functions of biological macromolecules is determined by its structural dynamics， and molecular dynamics simulation is an effective means to study its structural dynamics. Therefore，GROMACS is used to carry out molecular dynamics analysis to guide the further experimental work. This review mainly introduces the characteristics， basic process and the control of GROMACS， and the prospect of future prospects.
电子发声挂图Key words：Molecular dynamics simulation；GROMACS；Field湿地公园规划设计
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