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Chemical Science|May 22, 2018
Molecular mechanism of lytic polysaccharide monooxygenasesErik Donovan Hedegård, Ulf Ryde
Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|July 13, 2017
Targeting the reactive intermediate in polysaccharide monooxygenasesErik D Hedegård, Ulf Ryde
The Journal of Biological Chemistry|January 31, 2004
How O2 binds to heme: reasons for rapid binding and spin inversionKasper P Jensen, Ulf Ryde
Journal of Chemical Theory and Computation|October 27, 2018
Predicting Relative Binding Affinity Using Nonequilibrium QM/MM SimulationsMeiting Wang, Ye Mei, Ulf Ryde
The Journal of Physical Chemistry. B|February 7, 2008
Protonation of the proximal histidine ligand in heme peroxidasesJimmy Heimdal, Patrik Rydberg, Ulf Ryde
The Journal of Physical Chemistry. A|November 7, 2008
Prediction of activation energies for aromatic oxidation by cytochrome P450Patrik Rydberg, Ulf Ryde, Lars Olsen
Journal of Chemical Information and Modeling|September 30, 2014
A large-scale test of free-energy simulation estimates of protein-ligand binding affinitiesPaulius Mikulskis, Samuel Genheden, Ulf Ryde
Journal of Inorganic Biochemistry|March 23, 2021
Quantum-refinement studies of the bidentate ligand of V‑nitrogenase and the protonation state of CO-inhibited Mo‑nitrogenaseJustin Bergmann, Esko Oksanen, Ulf Ryde
Journal of Molecular Modeling|May 30, 2014
Effect of explicit water molecules on ligand-binding affinities calculated with the MM/GBSA approachPaulius Mikulskis, Samuel Genheden, Ulf Ryde
Journal of Computational Chemistry|July 13, 2002
Quantum chemical geometry optimizations in proteins using crystallographic raw dataUlf Ryde, Lars Olsen, Kristina Nilsson
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