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Titlebook: Computational Drug Discovery and Design; Riccardo Baron Book 2012 Springer Science+Business Media 2012 Computational Drug Design.Computat

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发表于 2025-3-21 19:00:21 | 显示全部楼层 |阅读模式
书目名称Computational Drug Discovery and Design
编辑Riccardo Baron
视频videohttp://file.papertrans.cn/233/232247/232247.mp4
概述Manual for state-of-the-art concepts and methodologies, as well as an advanced, specialized tool to design novel and orignial research for public health.Provides step-by-step detail essential for repr
丛书名称Methods in Molecular Biology
图书封面Titlebook: Computational Drug Discovery and Design;  Riccardo Baron Book 2012 Springer Science+Business Media 2012 Computational Drug  Design.Computat
描述.Due to the rapid and steady growth of available low-cost computer power, the use of computers for discovering and designing new drugs is becoming a central topic in modern molecular biology and medicinal chemistry. In .Computational Drug Discovery and Design: Methods and Protocols. expert researchers in the field provide key techniques to investigate biomedical applications for drug developments based on computational chemistry. These include methods and techniques from binding sites prediction to the accurate inclusion of solvent and entropic effects, from high-throughput screening of large compound databases to the expanding area of protein-protein inhibition, toward quantitative free-energy approaches in ensemble-based drug design using distributed computing. Written in the highly successful .Methods in Molecular Biology™. series format, chapters include introductions to their respective topics, reference to software and open source analysis tools, step-by-step, readily reproducible computational protocols, and key tips on troubleshooting and avoiding known pitfalls.. .Thorough and intuitive, .Computational Drug Discovery and Design: Methods and Protocols. aids scientists in th
出版日期Book 2012
关键词Computational Drug Design; Computational Drug Discovery; accurate inclusion of solvent; binding sites
版次1
doihttps://doi.org/10.1007/978-1-61779-465-0
isbn_softcover978-1-4939-6227-3
isbn_ebook978-1-61779-465-0Series ISSN 1064-3745 Series E-ISSN 1940-6029
issn_series 1064-3745
copyrightSpringer Science+Business Media 2012
The information of publication is updating

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发表于 2025-3-21 21:47:50 | 显示全部楼层
A Molecular Dynamics Ensemble-Based Approach for the Mapping of Druggable Binding Sites
发表于 2025-3-22 03:10:57 | 显示全部楼层
Analysis of Protein Binding Sites by Computational Solvent Mapping
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Evolutionary Trace for Prediction and Redesign of Protein Functional Sites
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Expanding the Conformational Selection Paradigm in Protein-Ligand Docking
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On the Use of Molecular Dynamics Receptor Conformations for Virtual Screening
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