Metadynamics simulations of ligand binding to GPCRs
Author:
Funder
Deutsche Forschungsgemeinschaft
Leibniz Rechenzentrum
Publisher
Elsevier BV
Subject
Molecular Biology,Structural Biology
Reference48 articles.
1. Molecular basis for the long duration of action and kinetic selectivity of tiotropium for the muscarinic M3 receptor;Tautermann;J Med Chem,2013
2. Induction of the tetracycline repressor: characterization by molecular-dynamics simulations;Haberl;Proteins,2009
3. Methodological advances: the unsung heroes of the GPCR structural revolution;Ghosh;Nat Rev Mol Cell Biol,2015
4. Replica-exchange molecular dynamics method for protein folding;Sugita;Chem Phys Lett,1999
5. Umbrella sampling;Kästner;WIREs Comput Mol Sci,2011
Cited by 26 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. Pathways and mechanism of MRTX1133 binding to KRAS G12D elucidated by molecular dynamics simulations and Markov state models;International Journal of Biological Macromolecules;2024-08
2. Characterization of binding kinetics and intracellular signaling of new psychoactive substances targeting cannabinoid receptor using transition-based reweighting method;2024-07-26
3. Characterization of binding kinetics and intracellular signaling of new psychoactive substances targeting cannabinoid receptor using transition-based reweighting method;2024-07-26
4. Deciphering the Key Loop: Enhancing l-Threonine Transaldolase’s Catalytic Potential;ACS Catalysis;2024-06-26
5. Determinants of Neutral Antagonism and Inverse Agonism in the β2-Adrenergic Receptor;Journal of Chemical Information and Modeling;2024-03-06
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