A semiempirical approach to ligand-binding affinities: Dependence on the Hamiltonian and corrections - researchr publication

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Paulius Mikulskis, Samuel Genheden, Karin Wichmann, Ulf Ryde. A semiempirical approach to ligand-binding affinities: Dependence on the Hamiltonian and corrections. Journal of Computational Chemistry, 33(12):1179-1189, 2012. [doi]

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