Computing spatially resolved rotational hydration-shell entropies from MD 
simulations using an orientational k-nearest-neighbor density estimator.

Heinz, L. P.; Grubmüller, H.

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Computing spatially resolved rotational hydration-shell entropies from MD simulations using an orientational k-nearest-neighbor density estimator.

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Heinz, L. P.
Department of Theoretical and Computational Biophysics, MPI for Biophysical Chemistry, Max Planck Society;

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Grubmüller, H.
Department of Theoretical and Computational Biophysics, MPI for Biophysical Chemistry, Max Planck Society;

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Heinz, L. P., & Grubmüller, H. (2020). Computing spatially resolved rotational hydration-shell entropies from MD simulations using an orientational k-nearest-neighbor density estimator. Biophysical Journal, 118(Suppl_1), 141A-141A.

Cite as: https://hdl.handle.net/21.11116/0000-0005-E4A8-C

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