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JUN 16, 2022

Desmond分子动力学模拟 | Molecular Dynamics Simulations

Speaker

Xiaohu Hu
Senior Scientist II

Abstract

胡小虎博士,薛定谔公司

“Desmond分子动力学模拟”培训将演示Desmond分子动力学工作流程,其中包括:

  • 体系准备
  • 基础动力学模拟和分子
  • 加强采样的技术入门
    • Metadynamics 入门
    • Replica Exchange Solute Tempering 入门

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