Evaluating Molecular Docking Software for Small Molecule Binding to G-Quadruplex DNA

Evaluating Molecular Docking Software for Small Molecule Binding to G-Quadruplex DNA

G-quadruplexes are four-stranded nucleic acid secondary structures of biological significance and have emerged as an attractive drug target. The G4 formed in the <i>MYC</i> promoter (MycG4) is one of the most studied small-molecule targets, and a model system for parallel structures that...

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Bibliographic Details
Main Authors: Jonathan Dickerhoff, Kassandra R. Warnecke, Kaibo Wang, Nanjie Deng, Danzhou Yang
Format: Article
Language:English
Published: MDPI AG 2021-10-01
Series:International Journal of Molecular Sciences
Subjects:
G-quadruplex
G4-ligands
docking
scoring
pose prediction
drug design
Online Access:https://www.mdpi.com/1422-0067/22/19/10801

Internet

https://www.mdpi.com/1422-0067/22/19/10801

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