Listar UJI: Investigación por autoría "87c4a953-be01-4df7-bf8e-b961679551a2"
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The effect of MM polarization on the QM/MM transition state stabilization: application to chorismate mutase
Illingworth, C .J. R.; Parkes, K. E.; Snell, C. R.; Martí Forés, Sergio; Moliner, Vicent; Reynolds, C. A. Taylor & Francis (2008)Hybrid quantum mechanics / molecular mechanics (QM/MM) calculations provide a mechanism for studying enzyme catalysed reactions at the molecular level. Here, through applications on the chorismate to prephenate rearrangement ...