Discovery of positive allosteric modulators of α7 nAChR by an ensemble-based virtual screening method, molecular dynamics simulation, and in vitro biological activity testing

Peiran Meng, Wenjun Mu, Daobo Ding,Huan Chen, Zhaohui Li,Hongwei Hou,Qingyuan Hu

Journal of Computational Biophysics and Chemistry(2024)

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