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

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]

Authors

Paulius Mikulskis

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Samuel Genheden

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Karin Wichmann

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Ulf Ryde

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