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Publications by Edina Rosta
Catalytic Mechanism of RNA Backbone Cleavage by Ribonuclease H From Quantum Mechanics/Molecular Mechanics Simulations
Journal of the American Chemical Society
Biochemistry
Colloid
Catalysis
Chemistry
Surface Chemistry
Cucurbit[7]uril as a Supramolecular Artificial Enzyme for Diels-Alder Reactions
Angewandte Chemie - International Edition
Catalysis
Chemistry
Phosphorylation of RAF Kinase Dimers Drives Conformational Changes That Facilitate Transactivation
Angewandte Chemie - International Edition
Catalysis
Chemistry
Insights Into Functions of the H Channel of Cytochromecoxidase From Atomistic Molecular Dynamics Simulations
Proceedings of the National Academy of Sciences of the United States of America
Multidisciplinary
Modular Supramolecular Dimerization of Optically Tunable Extended Aryl Viologens
Chemical Science
Chemistry
Understanding the Mechanism of the Hydrogen Abstraction From Arachidonic Acid Catalyzed by the Human Enzyme 15-Lipoxygenase-2. A Quantum Mechanics/Molecular Mechanics Free Energy Simulation
Journal of Chemical Theory and Computation
Theoretical Chemistry
Computer Science Applications
Physical
Cucurbit[7]uril as a Supramolecular Artificial Enzyme for Diels-Alder Reactions
Angewandte Chemie
Error and Efficiency of Replica Exchange Molecular Dynamics Simulations
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
On Possible Pitfalls in Ab Initio Quantum Mechanics/Molecular Mechanics Minimization Approaches for Studies of Enzymatic Reactions
Journal of Physical Chemistry B
Surfaces
Theoretical Chemistry
Materials Chemistry
Films
Medicine
Coatings
Physical
