药效团
虚拟筛选
对接(动物)
化学
药物发现
计算生物学
蛋白质-配体对接
组合化学
计算机科学
立体化学
生物化学
生物
医学
护理部
作者
Xiaochang Liu,Jiaxue Yu,Yong-Yan Luo,Haojian Dong
摘要
value of 0.74 ± 0.04 μM and 2.32 ± 0.84 μM respectively. Overall, the discovered GSK-3β inhibitors act as new chemical leads to develop improved inhibitors that block the interaction of GSK-3β, and the hybrid virtual screening strategy designed in this study provides an important reference for design and synthesis novel selective GSK-3β inhibitors.
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