A recursive molecular docking coupled with energy-based pose-rescoring and MD simulations to identify hsGC βH-NOX allosteric modulators for cardiovascular dysfunctions

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Tarih

2022

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ISSN

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Yayınevi

TAYLOR \& FRANCIS INC

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Anahtar kelimeler

Molecular docking, scoring function evaluation, human soluble guanylate cyclase, molecular dynamics simulations, clustering, per\\-residue energy decomposition

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URI

https://openaccess.acibadem.edu.tr/handle/11443/7431

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WOS

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