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Protein-Ligand Interactions

机译:蛋白质-配体相互作用

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摘要

Understanding the principles of protein-ligand interactions is at the heart of rational and computational drug design. This research field involves the medicinal chemistry of small organic molecules, the biophysics of protein structure and dynamics, and the physical chemistry of the surrounding solvent medium. It has therefore become a beautiful interdisciplinary forum for researchers from different experimental and theoretical backgrounds. Even if one focuses exclusively on computational research in this field, this involves researchers with backgrounds in several different disciplines, ranging from computational chemistry to theoretical biophysics and to structural bioinformatics. Many textbooks and more advanced texts have already addressed various facets of this field. An important new contribution is the book Protein-Ligand Interactions, edited by Holger Gohlke of the University of Dusseldorf, which recently appeared as Volume 53 in the Wiley-VCH series Methods and Principles in Medicinal Chemistry.
机译:理解蛋白质-配体相互作用的原理是合理和计算性药物设计的核心。该研究领域涉及有机小分子的药物化学,蛋白质结构和动力学的生物物理学,以及周围溶剂介质的物理化学。因此,对于来自不同实验和理论背景的研究人员来说,它已成为一个美丽的跨学科论坛。即使只专注于这一领域的计算研究,这也涉及具有不同学科背景的研究人员,从计算化学到理论生物物理学再到结构生物信息学。许多教科书和更高级的教科书已经解决了该领域的各个方面。杜塞尔多夫大学的霍尔格·戈尔克(Holger Gohlke)编辑的《蛋白质-配体相互作用》一书是一个重要的新贡献,该书最近在Wiley-VCH系列《药物化学方法和原理》中以第53卷的形式出现。

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