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The Journal of Physical Chemistry Letters|December 9, 2017
Electric Fields and Fast Protein Dynamics in EnzymesIoanna Zoi, Dimitri Antoniou, Steven D Schwartz
Molecular Physics|September 4, 2012
Barrier Crossing in Dihydrofolate Reductasedoes not involve a rate-promoting vibrationMariangela Dametto, Dimitri Antoniou, Steven D Schwartz
Methods in Enzymology|May 28, 2023
Atomistic description of the relationship between protein dynamics and catalysis with transition path samplingDimitri Antoniou, Ioanna Zoi, Steven D Schwartz
The Journal of Chemical Physics|September 28, 2004
Transition path sampling study of classical rate-promoting vibrationsDimitri Antoniou, Mohammad Ramin Abolfath, Steven D Schwartz
The Journal of Physical Chemistry. B|September 19, 2025
The Shaping of Enzymatic Free Energy Barriers through the Creation of Rate-Promoting Vibrations via Inter-Residue Cross-Talk on Multiple Time ScalesRakesh K Roy, Dimitri Antoniou, Steven D Schwartz
The Journal of Physical Chemistry Letters|August 12, 2015
Another Look at the Mechanisms of Hydride Transfer Enzymes with Quantum and Classical Transition Path SamplingMichael W Dzierlenga, Dimitri Antoniou, Steven D Schwartz
The Journal of Physical Chemistry. B|November 13, 2024
Transition Path Sampling Based Free Energy Calculations of Evolution's Effect on Rates in β-Lactamase: The Contributions of Rapid Protein Dynamics to RateClara F Frost, Dimitri Antoniou, Steven D Schwartz
ACS Catalysis|October 28, 2024
The Evolution of the Acylation Mechanism in <i>β</i>-Lactamase and Rapid Protein DynamicsClara F Frost, Dimitri Antoniou, Steven D Schwartz
ACS Catalysis|June 4, 2026
Fast Motions in 5 Alpha Reductase and Its Impact on Enzyme KineticsRakesh K Roy, Dimitri Antoniou, Steven D Schwartz
Journal of the American Chemical Society|June 15, 2019
Optimization of the Turnover in Artificial Enzymes via Directed Evolution Results in the Coupling of Protein Dynamics to ChemistryJoseph W Schafer, Ioanna Zoi, Dimitri Antoniou, et al.
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