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A Novel Strategy to Study Electrostatic Effects in Chemical Reactions: Differences between the Role of Solvent and the Active Site of Chalcone Isomerase in a Michael Addition
Ruiz-Pernía, J. Javier, Martí, Sergio, Moliner, Vicent, Tuñón, IñakiVolume:
8
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct300064f
Date:
May, 2012
File:
PDF, 1.17 MB
english, 2012