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推进用于新药标的活性化合物发现:来自人工智能驱动方法的见解

Xing-You Wang1,2, Yang Chen1,2,3, Yu-Fan Li1,2

  • 1Drug Discovery and Design Center, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica Chinese Academy of Sciences, Shanghai, 201203, China.

Acta pharmacologica Sinica
|June 17, 2025
PubMed
概括

人工智能 (AI) 通过改进分子设计,目标识别和用于新疗法的数据分析来加速药物发现. 人工智能提高了寻找具有挑战性的疾病活性化合物的效率和准确性.

关键词:
人工智能驱动的药物发现联结子勘探 联结子勘探分子设计分子设计.新型药物目标 新型药物目标现型的药物发现.无法达到的目标是不可抗拒的目标.

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