How do SET-domain Protein Lysine Methyltransferases Achieve the Methylation State Specificity? Revisited by ab initio QM/MM Molecular Dynamics Simulations

Eitemau Tebyg

• Ab initio QM/MM Molecular Dynamics Simulation of Enzyme Catalysis: The Case of Histone Lysine Methyltransferase SET7/9
  gan: Wang, Shenglong, et al.
  Cyhoeddwyd: (2007)
• Born-Oppenheimer ab initio QM/MM Molecular Dynamics Simulations of Enzyme Reactions
  gan: Zhou, Yanzi, et al.
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• Increasing the Time Step with Mass Scaling in Born-Oppenheimer ab initio QM/MM Molecular Dynamics Simulations
  gan: Zheng, Han, et al.
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  gan: Zhou, Yanzi, et al.
  Cyhoeddwyd: (2010)
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  gan: Hu, Po, et al.
  Cyhoeddwyd: (2008)