Theoretical Studies on the Selectivity Mechanisms of Glycogen Synthase Kinase 3β (GSK3β) with Pyrazine ATP-competitive Inhibitors by 3D-QSAR, Molecular Docking, Molecular Dynamics Simulation and Free 
Energy Calculations

BACKGROUND: Glycogen synthase kinase-3 (GSK3) is associated with various key biological processes and has been considered as an important therapeutic target for the treatment of many diseases. Great efforts have been made on the development of GSK3 inhibitors, especially ATP-competitive GSK3β inhibi...

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Detalles Bibliográficos
Autores principales: Zhu, Jingyu, Wu, Yuanqing, Xu, Lei, Jin, Jian
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Bentham Science Publishers 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6967214/
https://www.ncbi.nlm.nih.gov/pubmed/31284868
http://dx.doi.org/10.2174/1573409915666190708102459

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6967214/
https://www.ncbi.nlm.nih.gov/pubmed/31284868
http://dx.doi.org/10.2174/1573409915666190708102459

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