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The Journal of Physical Chemistry. B|October 30, 2010
Soft wall ion channel in continuum representation with application to modeling ion currents in α-hemolysinNikolay A Simakov, Maria G Kurnikova
The Journal of Membrane Biology|January 18, 2018
Membrane Position Dependency of the pKa and Conductivity of the Protein Ion ChannelNikolay A Simakov, Maria G Kurnikova
IEEE Transactions on Nanobioscience|April 9, 2005
Poisson-Nernst-Planck theory approach to the calculation of current through biological ion channelsRob D Coalson, Maria G Kurnikova
ACS Chemical Neuroscience|October 10, 2019
AMPA Receptor Noncompetitive Inhibitors Occupy a Promiscuous Binding SiteChamali Narangoda, Serzhan N Sakipov, Maria G Kurnikova
Scientific Reports|April 11, 2018
Ion Permeation Mechanism in Epithelial Calcium Channel TRVP6Serzhan Sakipov, Alexander I Sobolevsky, Maria G Kurnikova
Biophysical Chemistry|June 27, 2006
Diffusion constant of K+ inside Gramicidin A: a comparative study of four computational methodsArtem B Mamonov, Maria G Kurnikova, Rob D Coalson
Journal of Chemical Information and Modeling|January 4, 2023
Active Learning Guided Drug Design Lead Optimization Based on Relative Binding Free Energy ModelingFilipp Gusev, Evgeny Gutkin, Maria G Kurnikova, et al.
Redox Biology|January 16, 2017
Molecular mechanisms of bio-catalysis of heme extraction from hemoglobinSerzhan Sakipov, Olga Rafikova, Maria G Kurnikova, et al.
The Journal of Physical Chemistry. B|May 17, 2019
A Hierarchical Approach to Predict Conformation-Dependent Histidine Protonation States in Stable and Flexible ProteinsSerzhan N Sakipov, Jose C Flores-Canales, Maria G Kurnikova
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