Entropy–Entropy Compensation between the Protein, Ligand, and Solvent Degrees of Freedom Fine-Tunes Affinity in Ligand Binding to Galectin-3C von Wallerstein, Johan, Ekberg, Vilhelm, Ignjatović, Majda Misini, Kumar, Rohit, Caldararu, Octav, Peterson, Kristoffer, Wernersson, Sven, Brath, Ulrika, Leffler, Hakon, Oksanen, Esko, Logan, Derek T., Nilsson, Ulf J., Ryde, Ulf, Akke, Mikael

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On the Use of Interaction Entropy and Related Methods to Estimate Binding Entropies von Ekberg, Vilhelm, Ryde, Ulf

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Interplay of halogen bonding and solvation in protein–ligand binding von Verteramo, Maria Luisa, Ignjatović, Majda Misini, Kumar, Rohit, Wernersson, Sven, Ekberg, Vilhelm, Wallerstein, Johan, Carlström, Göran, Chadimová, Veronika, Leffler, Hakon, Zetterberg, Fredrik, Logan, Derek T., Ryde, Ulf, Akke, Mikael, Nilsson, Ulf J.

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Free-energy studies of ligand-binding affinities von Ekberg, Vilhelm

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Exploring ligand dynamics in protein crystal structures with ensemble refinement von Caldararu, Octav, Ekberg, Vilhelm, Logan, Derek T., Oksanen, Esko, Ryde, Ulf

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Comparison of Grand Canonical and Conventional Molecular Dynamics Simulation Methods for Protein-Bound Water Networks von Ekberg, Vilhelm, Samways, Marley L., Misini Ignjatović, Majda, Essex, Jonathan W., Ryde, Ulf

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