Consideration of Water and Solvation Effects in Virtual Screening
Author:
Publisher
Wiley-VCH Verlag GmbH & Co. KGaA
Link
http://onlinelibrary.wiley.com/wol1/doi/10.1002/9783527633326.ch10/fullpdf
Reference133 articles.
1. Water, water everywhere: except where it matters?;Homans;Drug Discovery Today,2007
2. Standard free energy of releasing a localized water molecule from the binding pockets of proteins: double-decoupling method;Hamelberg;Journal of the American Chemical Society,2004
3. Classification of water molecules in protein binding sites;Barillari;Journal of the American Chemical Society,2007
4. Analysis of ligand-bound water molecules in high-resolution crystal structures of protein-ligand complexes;Lu;Journal of Chemical Information and Modeling,2007
5. Strong and weak hydrogen bonds in the protein-ligand interface;Panigrahi;Proteins: Structure, Function, and Bioinformatics,2007
Cited by 8 articles. 订阅此论文施引文献 订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献
1. Computational chemistry in drug lead discovery and design;International Journal of Quantum Chemistry;2018-09-24
2. Virtual Screening;Small Molecule Medicinal Chemistry;2015-09-26
3. Structure‐Based Methods for Predicting the Sites and Products of Metabolism;Methods and Principles in Medicinal Chemistry;2014-07-11
4. (How to) Profit from Molecular Dynamics-based Ensemble Docking;Challenges and Advances in Computational Chemistry and Physics;2014
5. Combining Solvent Thermodynamic Profiles with Functionality Maps of the Hsp90 Binding Site to Predict the Displacement of Water Molecules;Journal of Chemical Information and Modeling;2013-10-15
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线，采集、加工和组织学术论文而形成的新型学术文献查询和分析系统，可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容，当前同舟云学术共收录了国内外主流学术期刊6万余种，收集的期刊论文及会议论文总量共计约1.5亿篇，并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询！咨询电话：010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3