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Andrey O Demkiv

Showing results (1-10 of 6) with videos related to

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Journal of Chemical Theory and Computation|April 17, 2026
Thermodynamic Activation Parameters for Chemical Reactions in Enzymes and Solution from Computer Simulations at a Single TemperatureFlorian van der Ent, Andrey O Demkiv, Johan Åqvist
Trends in Biochemical Sciences|September 21, 2021
Exploiting enzyme evolution for computational protein designGaspar P Pinto, Marina Corbella, Andrey O Demkiv, et al.
Journal of Molecular Graphics & Modelling|January 7, 2023
Q-RepEx: A Python pipeline to increase the sampling of empirical valence bond simulationsSebastian Brickel, Andrey O Demkiv, Rory M Crean, et al.
Biorxiv : the Preprint Server for Biology|May 15, 2024
Catalytic Redundancies and Conformational Plasticity Drives Selectivity and Promiscuity in Quorum Quenching LactonasesMarina Corbella, Joe Bravo, Andrey O Demkiv, et al.
JACS Au|September 27, 2024
Catalytic Redundancies and Conformational Plasticity Drives Selectivity and Promiscuity in Quorum Quenching LactonasesMarina Corbella, Joe Bravo, Andrey O Demkiv, et al.
Molecular Biology and Evolution|March 12, 2025
Redefining the Limits of Functional Continuity in the Early Evolution of P-Loop NTPasesAndrey O Demkiv, Saacnicteh Toledo-Patiño, Encarnación Medina-Carmona, et al.
Pageof 1

Showing results (1-10 of 6) with videos related to

Sort By:
Pageof 1
Journal of Chemical Theory and Computation|April 17, 2026
Thermodynamic Activation Parameters for Chemical Reactions in Enzymes and Solution from Computer Simulations at a Single TemperatureFlorian van der Ent, Andrey O Demkiv, Johan Åqvist
Trends in Biochemical Sciences|September 21, 2021
Exploiting enzyme evolution for computational protein designGaspar P Pinto, Marina Corbella, Andrey O Demkiv, et al.
Journal of Molecular Graphics & Modelling|January 7, 2023
Q-RepEx: A Python pipeline to increase the sampling of empirical valence bond simulationsSebastian Brickel, Andrey O Demkiv, Rory M Crean, et al.
Biorxiv : the Preprint Server for Biology|May 15, 2024
Catalytic Redundancies and Conformational Plasticity Drives Selectivity and Promiscuity in Quorum Quenching LactonasesMarina Corbella, Joe Bravo, Andrey O Demkiv, et al.
JACS Au|September 27, 2024
Catalytic Redundancies and Conformational Plasticity Drives Selectivity and Promiscuity in Quorum Quenching LactonasesMarina Corbella, Joe Bravo, Andrey O Demkiv, et al.
Molecular Biology and Evolution|March 12, 2025
Redefining the Limits of Functional Continuity in the Early Evolution of P-Loop NTPasesAndrey O Demkiv, Saacnicteh Toledo-Patiño, Encarnación Medina-Carmona, et al.
Pageof 1