Building 2D Classification Models and 3D CoMSIA Models on Small-Molecule Inhibitors of Both Wild-Type and T790M/L858R Double-Mutant EGFR

Huo Donghui,Wang Hongzhao,Qin Zijian,Tian Yujia,Yan Aixia

Molecular Diversity（2021）

Cited 6|Views9

Key words

Epidermal growth factor receptor (EGFR) inhibitors,T790M/L858R double-mutant EGFR,Quantitative structure–activity relationship (QSAR),Comparative molecular similarity analysis (CoMSIA),Self-attention recurrent neural network (RNN),Self-organizing map (SOM)

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