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Updated: Jul 25, 2025

Quantitative Structure-Activity Relationship, Activity Prediction, and Molecular Dynamics of Non-nucleotide Reverse Transcriptase Inhibitors
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自动机器学习方法用于开发心脏类固醇抑制Na+/K+-ATPase定量结构-活性关系模型

Yohei Takada1, Kazuhiro Kaneko2

  • 1Corporate Planning Department, Otsuka Holdings Co., Ltd, Shinagawa Grand Central Tower 2-16-4 Konan, Minato-ku, Tokyo, 108-8241, Japan. takaday@otsuka.jp.

Pharmacological reports : PR
|June 24, 2023
PubMed
概括

自动机器学习创建了一个定量结构-活性关系 (QSAR) 模型来预测心脏类固醇 (CS) 活性. 这种方法可以有效地识别潜在的候选药物,而无需进行广泛的实验.

关键词:
心脏类固醇可以治疗心脏.机器学习 机器学习建模建模模型是什么纳+/K+-ATPase是一种酶.

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