Kortney Melancon1,2, Palina Pliushcheuskaya3, Jens Meiler1,2,3,4

  • 1Department of Chemistry, Vanderbilt University, Nashville, TN, United States.

概括

计算化学加速了对离子通道目标的药物发现. 本综述涵盖了超大复合库的虚拟选和机器学习等in silico方法,有助于癌症和疼痛等疾病的研究.