QM/MM Calculations on Proteins von Ryde, U

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How to obtain statistically converged MM/GBSA results von Genheden, Samuel, Ryde, Ulf

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On the significance of hydrogen bonds for the discrimination between CO and O2 by myoglobin von Sigfridsson, E, Ryde, U

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Recent development in quantum refinement of protein structures von Ryde, U., Lundgren, K., Oksanen, E.

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Geometry, Reduction Potential, and Reorganization Energy of the Binuclear CuA Site, Studied by Density Functional Theory von Olsson, Mats H. M, Ryde, Ulf

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Inner-Sphere Reorganization Energy of Iron−Sulfur Clusters Studied with Theoretical Methods von Sigfridsson, Emma, Olsson, Mats H. M, Ryde, Ulf

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Accuracy of distributed multipoles and polarizabilities: Comparison between the LoProp and MpProp models von Söderhjelm, P., Krogh, J. W., Karlström, G., Ryde, U., Lindh, R.

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Binding of Benzylpenicillin to Metallo-β-lactamase:  A QM/MM Study von Olsen, Lars, Rasmussen, T, Hemmingsen, L, Ryde, U

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The influence of axial ligands on the reduction potential of blue copper proteins von Olsson, M H, Ryde, U

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On the role of Glu‐68 in alcohol dehydrogenase von Ryde, Ulf

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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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How O-2 binds to heme - Reasons for rapid binding and spin inversion von Jensen, Kasper, Ryde, Ulf

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Importance of proximal hydrogen bonds in haem proteins von Jensen, Kasper, Ryde, Ulf

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Combined quantum and molecular mechanics calculations on metalloproteins von Ryde, Ulf

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Quantum chemical calculations of the reorganization energy of blue‐copper proteins von Olsson, Mats H.M., Ryde, Ulf, Roos, Björn O.

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Quantum Chemistry Can Locally Improve Protein Crystal Structures von Ryde, Ulf, Nilsson, Kristina

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MOLCAS: a program package for computational chemistry von Karlström, Gunnar, Lindh, Roland, Malmqvist, Per-Åke, Roos, Björn O, Ryde, Ulf, Veryazov, Valera, Widmark, Per-Olof, Cossi, Maurizio, Schimmelpfennig, Bernd, Neogrady, Pavel, Seijo, Luis

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Carboxylate Binding Modes in Zinc Proteins: A Theoretical Study von Ryde, Ulf

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On the role of the axial ligand in heme proteins: a theoretical study von Rydberg, Patrik, Sigfridsson, Emma, Ryde, Ulf

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Quantum mechanical free energy barrier for an enzymatic reaction von ROD, Thomas H, RYDE, Ulf

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