Ab initio QM/MM Molecular Dynamics Simulation of Enzyme Catalysis: The Case of Histone Lysine Methyltransferase SET7/9

Ähnliche Einträge

• How do SET-domain Protein Lysine Methyltransferases Achieve the Methylation State Specificity? Revisited by ab initio QM/MM Molecular Dynamics Simulations
  von: Hu, Po, et al.
  Veröffentlicht: (2008)
• Born-Oppenheimer ab initio QM/MM Molecular Dynamics Simulations of Enzyme Reactions
  von: Zhou, Yanzi, et al.
  Veröffentlicht: (2016)
• A Highly Dissociative and Concerted Mechanism for the Nicotinamide Cleavage Reaction in Sir2Tm Enzyme Suggested by ab initio QM/MM Molecular Dynamics Simulations
  von: Hu, Po, et al.
  Veröffentlicht: (2008)
• Ab initio QM/MM free-energy studies of arginine deiminase catalysis: The protonation state of the Cys nucleophile
  von: Ke, Zhihong, et al.
  Veröffentlicht: (2011)
• Increasing the Time Step with Mass Scaling in Born-Oppenheimer ab initio QM/MM Molecular Dynamics Simulations
  von: Zheng, Han, et al.
  Veröffentlicht: (2009)