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Updated: Jun 21, 2025

Nano-Differential Scanning Fluorimetry for Screening in Fragment-based Lead Discovery
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用机器学习和分子动力学技术在二二二酶-4抑制中发现化合物的计算方法

Sandra De La Torre1, Sebastián A Cuesta2, Luis Calle3

  • 1Grupo de Química Computacional y Teórica (QCT-USFQ), Departamento de Ingeniería Química, Universidad San Francisco de Quito, Diego de Robles y Vía Interoceánica, Quito 170901, Ecuador.

Computational biology and chemistry
|July 13, 2024
PubMed
概括

这项研究开发了一种机器学习模型,用于预测二二酶-4 (DPP-4) 抑制剂对2型糖尿病 (T2DM) 的作用. 通过虚拟查确定了有前途的候选药物,减少了药物开发时间和成本.

关键词:
糖尿病是一种糖尿病.双基酸酶-4的二基-4的二基-4的二基-4的二基-4的药物发现 药物发现药品银行药品银行分子动力学分子动力学

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