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Updated: May 28, 2025

Modeling an Enzyme Active Site using Molecular Visualization Freeware
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Modeling an Enzyme Active Site using Molecular Visualization Freeware

Published on: December 25, 2021

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CHARMM-GUI EnzyDocker用于在酶中的反应坐标沿着多个反应状态的蛋白质 - 连接体对接

Donghyuk Suh1, Renana Schwartz2, Prashant Kumar Gupta2

  • 1Department of Biological Sciences, Lehigh University, Bethlehem, Pennsylvania 18015, United States.

Journal of chemical theory and computation
|February 14, 2025
PubMed
概括

CHARMM-GUI EnzyDocker简化了复杂的酶对接模拟. 这个网络工具简化了多状态和多尺度对接,使预测酶反应路径变得更容易.

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