药物发现
药品
动力学
受体-配体动力学
计算生物学
化学
计算机科学
纳米技术
医学
生物
物理
药理学
材料科学
生物化学
量子力学
作者
Victor A. Adediwura,Kushal Koirala,N. Hung,Jinan Wang,Yinglong Miao
标识
DOI:10.1080/17460441.2024.2349149
摘要
For rational drug design, it is crucial to understand the receptor-drug binding processes and mechanisms. A new era for the use of computer simulations in predicting drug-receptor interactions at an atomic level has begun with remarkable advances in supercomputing and methodological breakthroughs.
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