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Updated: Jan 31, 2026

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基准深度学习模型用于预测抗癌药物效率 (IC50) 与药物化学家的见解

Udbhas Garai1, Aditya S Pal2, Koyel Ghosh3

  • 1Department of Chemical Sciences, Indian Institute of Science Education and Research Mohali, SAS Nagar (Mohali), Punjab, India.

Communications chemistry
|January 29, 2026
PubMed
概括

深度学习模型对预测抗癌药物强度 (IC50) 有希望,但对于新型化合物,准确性下降. DeepCDR,DrugCell和tCNN的表现最好,尽管一些模型在简单的基线上扎.

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