Exploring Conformational Change of Adenylate Kinase by Replica Exchange Molecular Dynamic Simulation

Replica exchange molecular dynamics (REMD) simulation is a popular enhanced sampling method that is widely used for exploring the atomic mechanism of protein conformational change. However, the requirement of huge computational resources for REMD, especially with the explicit solvent model, largely...

Disgrifiad llawn

Wedi'i Gadw mewn:
Manylion Llyfryddiaeth
Cyhoeddwyd yn:Biophys J
Prif Awduron: Wang, Jinan, Peng, Cheng, Yu, Yuqu, Chen, Zhaoqiang, Xu, Zhijian, Cai, Tingting, Shao, Qiang, Shi, Jiye, Zhu, Weiliang
Fformat: Artigo
Iaith:Inglês
Cyhoeddwyd: The Biophysical Society 2020
Pynciau:
Articles
Mynediad Ar-lein:https://ncbi.nlm.nih.gov/pmc/articles/PMC7063423/
https://ncbi.nlm.nih.gov/pubmed/31995738
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpj.2020.01.001
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