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Updated: Jul 17, 2025

A Rapid and Quantitative Fluorimetric Method for Protein-Targeting Small Molecule Drug Screening
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无描述符的深度学习QSAR模型用于人类等离子体中未结合的分数

Michael Riedl1, Sayak Mukherjee1, Mitch Gauthier1

  • 1Battelle, Columbus, Ohio 43201, United States.

Molecular pharmaceutics
|September 1, 2023
PubMed
概括

本研究引入了一种新的自然语言处理方法,用于定量结构-活性关系 (QSAR) 建模,绕过传统的化学描述符. 该方法有效地预测化学性质,如分数不结合,降低药物发现的计算成本.

关键词:
贝尔特 (BERT) 公司在QSAR中使用QSAR.深度学习是一种深度学习.分数没有绑定.人类血的人类血.

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