Improved Treatment of Ligands and Coupling Effects in Empirical Calculation and Rationalization of p K a Values

Chresten R. Søndergaard, Mats H. M. Olsson, Michał Rostkowski, Jan H. Jensen
  • Journal of Chemical Theory and Computation, July 2011, American Chemical Society (ACS)
  • DOI: 10.1021/ct200133y

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The following have contributed to this page: Jan H Jensen