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Screening of Potential Drug for Alzheimer's Disease: a Computational Study with GSK-3 Β Inhibition Through Virtual Screening, Docking, and Molecular Dynamics Simulation.

Journal of Biomolecular Structure and Dynamics(2020)

引用 17|浏览11
关键词
AD,GSK-3 beta,compound 6961,virtual screening,induced-fit docking,molecular dynamics simulation,binding free energy calculation
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