How could simulations elucidate Nav1.5 channel blockers mechanism?

IF 3.3 2区 医学 Q1 PHYSIOLOGY Journal of General Physiology Pub Date : 2025-03-03 Epub Date: 2025-01-07 DOI:10.1085/jgp.202413730
Tanadet Pipatpolkai
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引用次数: 0

Abstract

Tao and Corry used metadynamics, an enhanced sampling method to identify and classify Nav channel blockers.

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模拟如何阐明Nav1.5通道阻滞剂的机制?
Tao和Corry使用元动力学,一种增强的采样方法来识别和分类导航通道阻断剂。
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来源期刊
CiteScore
6.00
自引率
10.50%
发文量
88
审稿时长
6-12 weeks
期刊介绍: General physiology is the study of biological mechanisms through analytical investigations, which decipher the molecular and cellular mechanisms underlying biological function at all levels of organization. The mission of Journal of General Physiology (JGP) is to publish mechanistic and quantitative molecular and cellular physiology of the highest quality, to provide a best-in-class author experience, and to nurture future generations of independent researchers. The major emphasis is on physiological problems at the cellular and molecular level.
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Mechanisms underlying the distinct K+ dependencies of periodic paralysis. Reduced voltage-activated Ca2+ release flux in muscle fibers from a rat model of Duchenne dystrophy. ALLIN: A tool for annotation of a protein alignment combined with structural visualization. How could simulations elucidate Nav1.5 channel blockers mechanism? Drugs exhibit diverse binding modes and access routes in the Nav1.5 cardiac sodium channel pore.
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