49 citations · 514 across the 43 of their papers we have counts for
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Electrostatic fluctuations promote the dynamical transition in proteins
Dmitry V. Matyushov, Alexander Y. Morozov
Atomic displacements of hydrated proteins are dominated by phonon vibrations at low temperatures and by dissipative large-amplitude motions at high temperatures. A crossover betwee…
Potential-tuning molecular dynamics studies of fusion, and the question of ideal glassformers: (I) The Gay-Berne model
Vitaliy Kapko, Dmitry V. Matyushov, C. Austen Angell
The ability of some liquids to vitrify during supercooling is usually seen as a consequence of the rates of crystal nucleation (and/or crystal growth) becoming small- thus a matter…
Cavity-water interface is polar
Allan D. Friesen, Dmitry V. Matyushov
We present the results of numerical simulations of the electrostatics and dynamics of water hydration shells surrounding Kihara cavities given by a Lennard-Jones (LJ) layer at the…
Ferroelectric hydration shells around proteins: Electrostatics of the protein/water interface
David N. LeBard, Dmitry V. Matyushov
Numerical simulations of hydrated proteins show that protein hydration shells are polarized into a ferroelectric cluster with a large magnitude of its average dipole moment. The em…