Reaction Mechanism of Caspases : Insights from QM / MM Car – Parrinello Simulations

  • Sulpizi M
  • Laio A
  • Vandevondele J
 et al. 
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Author-supplied keywords

  • caspases
  • cysteine proteases
  • first-principles calcula-
  • mechanism
  • reaction

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  • M Sulpizi

  • a Laio

  • J Vandevondele

  • a Cattaneo

  • U Rothlisberger

  • P Carloni

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