| 1 |
Epoxidation Catalyzed by the Nonheme Iron(II)- and 2-Oxoglutarate-Dependent Oxygenase, AsqJ: Mechanistic Elucidation of Oxygen Atom Transfer by a Ferryl Intermediate
Li JK, Liao HJ, Tang YJ, Huang JL, Cha L, Lin TS, Lee JL, Kurnikov IV, Kurnikova MG, Chang WC, Chan NL, Guo YS
Journal of the American Chemical Society, 142(13), 6268, 2020 |
| 2 |
A Hierarchical Approach to Predict Conformation-Dependent Histidine Protonation States in Stable and Flexible Proteins
Sakipov SN, Flores-Canales JC, Kurnikova MG
Journal of Physical Chemistry B, 123(24), 5024, 2019 |
| 3 |
Soft Wall Ion Channel in Continuum Representation with Application to Modeling Ion Currents in alpha-Hemolysin
Simakov NA, Kurnikova MG
Journal of Physical Chemistry B, 114(46), 15180, 2010 |
| 4 |
Comparison of dynamic lattice Monte Carlo simulations and the dielectric self-energy Poisson-Nernst-Planck continuum theory for model ion channels
Graf P, Kurnikova MG, Coalson RD, Nitzan A
Journal of Physical Chemistry B, 108(6), 2006, 2004 |
| 5 |
Energetics and dynamics of a cyclic oligosaccharide molecule in a confined protein pore environment. A molecular dynamics study
Shilov IY, Kurnikova MG
Journal of Physical Chemistry B, 107(29), 7189, 2003 |
| 6 |
A dynamic lattice Monte Carlo model of ion transport in inhomogeneous dielectric environments: Method and implementation
Graf P, Nitzan A, Kurnikova MG, Coalson RD
Journal of Physical Chemistry B, 104(51), 12324, 2000 |
| 7 |
Rotational relaxation of ionic molecules in electrolyte solutions. Anisotropy relaxation and molecular dynamics study
Balabai N, Kurnikova MG, Coalson RD, Waldeck DH
Journal of the American Chemical Society, 120(31), 7944, 1998 |
| 8 |
Rotational relaxation in polar solvents. Molecular dynamics study of solute-solvent interaction
Kurnikova MG, Balabai N, Waldeck DH, Coalson RD
Journal of the American Chemical Society, 120(24), 6121, 1998 |
| 9 |
A Molecular-Dynamics Study of Photothermal Compression of Colloidal Crystals
Zahorchak JC, Kurnikova MG, Coalson RD
Journal of Chemical Physics, 106(4), 1585, 1997 |
| 10 |
Structural Fluctuations, Spin, Reorganization Energy, and Tunneling Energy Control of Intramolecular Electron-Transfer - The Surprising Case of Electron-Transfer in a D(8)-D(8) Bimetallic System
Kurnikov IV, Zusman LD, Kurnikova MG, Farid RS, Beratan DN
Journal of the American Chemical Society, 119(24), 5690, 1997 |
