Accounting for Conformational Variability in Protein–Ligand Docking with NMR-Guided Rescoring-Reference-Cited by-同舟云学术

登录注册会员服务联系我们

Accounting for Conformational Variability in Protein–Ligand Docking with NMR-Guided Rescoring

Published:2013-04-08 Issue:15 Volume:135 Page:5819-5827
ISSN:0002-7863
Container-title:Journal of the American Chemical Society
language:en
Short-container-title:J. Am. Chem. Soc.

Author:

Skjærven Lars¹,Codutti Luca¹,Angelini Andrea¹,Grimaldi Manuela¹²,Latek Dorota¹,Monecke Peter³,Dreyer Matthias K.³,Carlomagno Teresa¹

Affiliation:

1. EMBL, Structural and Computational Biology Unit, Meyerhofstraße 1, D-69117 Heidelberg, Germany

2. Department of Biomedical and Pharmaceutical Sciences, University of Salerno, Via Ponte Don Melillo 8, 84024 Fisciano (SA), Italy

3. Sanofi-Aventis Deutschland GmbH R&D LGCR/Structure, Design & Informatics, Industriepark Höchst, Bldg. G838, D-65926 Frankfurt am Main, Germany

Publisher

American Chemical Society (ACS)

Subject

Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis

Link

https://pubs.acs.org/doi/pdf/10.1021/ja4007468

Reference59 articles.

1. The Many Roles of Computation in Drug Discovery

2. Efficient Drug Lead Discovery and Optimization

3. Efficient Discovery of Potent Anti-HIV Agents Targeting the Tyr181Cys Variant of HIV Reverse Transcriptase

4. Blind docking of pharmaceutically relevant compounds using RosettaLigand

5. Protein−Ligand Docking against Non-Native Protein Conformers

Cited by 24 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. INPHARMA‐Based Determination of Ligand Binding Modes at α 1 ‐Adrenergic Receptors Explains the Molecular Basis of Subtype Selectivity;Chemistry – A European Journal;2020-08-18

2. NMR Studies of Protein–Small Molecule Interactions for Drug Discovery;Structural Biology in Drug Discovery;2020-01-02

3. Structure-based design of human pancreatic amylase inhibitors from the natural anthocyanin database for type 2 diabetes;Food & Function;2020

4. Determination of protein–ligand binding modes using fast multi-dimensional NMR with hyperpolarization;Chemical Science;2020

5. NMR screening and studies of target – ligand interactions;Russian Chemical Reviews;2019-01-01

同舟云学术

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