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Updated: Feb 28, 2026

Modeling an Enzyme Active Site using Molecular Visualization Freeware
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UniKineG:统一坐标的几何图形使强大的酶动力学预测成为可能

Xueyu Wang1, Peiqin Shi2, Jian Mao2,3

  • 1School of Artificial Intelligence and Computer Science, Jiangnan University, Wuxi 214122, China.

International journal of molecular sciences
|February 27, 2026
PubMed
概括

UniKineG是一个新的深度学习模型,通过分析酶基质3D结构,准确地预测酶动态参数. 这种计算工具增强了对酶-小分子相互作用的理解,用于药物发现.

关键词:
深度学习是一种深度学习.酶动力学参数 酶动力学参数图表 卷积网络 卷积网络不同质的图形是不同的图形.分子对接的分子对接.

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