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使用新型LSTM编码解码模型生成潜在的RET特定抑制剂

Lu Liu1, Xi Zhao1, Xuri Huang1

  • 1Institute of Theoretical Chemistry, College of Chemistry, Jilin University, Changchun 130061, China.

International journal of molecular sciences
|February 24, 2024
PubMed
概括

研究人员开发了一种新的分子生成模型,以创建特定的RET激酶抑制剂,解决现有的多激酶药物的挑战. 这种人工智能驱动的方法可以快速识别癌症治疗的有前途的候选药物.

关键词:
在RET的基础上,RET是RET.深度学习是一种深度学习.编码器解码器网络长时间的短期记忆 (LSTM)分子动力学模拟模拟虚拟选 虚拟选 虚拟选

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