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Theoretical Exploring Selective-Binding Mechanisms of JAK3 by 3D-QSAR, Molecular Dynamics Simulation and Free Energy Calculation

Janus kinase 3 (JAK3) plays a critical role in the JAK/STAT signaling pathway and has become an attractive selective target for the treatment of immune-mediated disorders. Therefore, great efforts have been made for the development of JAK3 inhibitors, but developing selective JAK3 inhibitors remains...

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Detalles Bibliográficos
Autores principales:	Zhu, Jingyu, Yu, Qianqian, Cai, Yanfei, Chen, Yun, Liu, Hui, Liang, Wenqing, Jin, Jian
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Frontiers Media S.A. 2020
Materias:	Molecular Biosciences
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7266956/ https://www.ncbi.nlm.nih.gov/pubmed/32528970 http://dx.doi.org/10.3389/fmolb.2020.00083

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