Pete Kekenes-Huskey
Pete Kekenes-Huskey
Loyola University Chicago - Stritch School of Medicine
Verified email at uky.edu - Homepage
Title
Cited by
Cited by
Year
Solvent fluctuations in hydrophobic cavity–ligand binding kinetics
P Setny, R Baron, PM Kekenes-Huskey, JA McCammon, J Dzubiella
Proceedings of the National Academy of Sciences 110 (4), 1197-1202, 2013
832013
Modelling cardiac calcium sparks in a three‐dimensional reconstruction of a calcium release unit
J Hake, AG Edwards, Z Yu, PM Kekenes‐Huskey, AP Michailova, ...
The Journal of Physiology 590 (18), 4403-4422, 2012
752012
Dynamics and Calcium Association to the N-Terminal Regulatory Domain of Human Cardiac Troponin C: A Multiscale Computational Study
S Lindert, PM Kekenes-Huskey, G Huber, L Pierce, JA McCammon
The Journal of Physical Chemistry B, 2012
482012
A model study of sequential enzyme reactions and electrostatic channeling
C Eun, PM Kekenes-Huskey, VT Metzger, JA McCammon
The Journal of chemical physics 140 (10), 03B607_1, 2014
452014
The MPSim‐Dock hierarchical docking algorithm: Application to the eight trypsin inhibitor cocrystals
AE Cho, JA Wendel, N Vaidehi, PM Kekenes–Huskey, WB Floriano, ...
Journal of computational chemistry 26 (1), 48-71, 2004
392004
Effects of HCM cTnI mutation R145G on troponin structure and modulation by PKA phosphorylation elucidated by molecular dynamics simulations
S Lindert, Y Cheng, P Kekenes-Huskey, M Regnier, JA McCammon
Biophysical journal 108 (2), 395-407, 2015
382015
A molecular docking study of estrogenically active compounds with 1, 2-diarylethane and 1, 2-diarylethene pharmacophores
PM Kekenes-Huskey, I Muegge, M von Rauch, R Gust, EW Knapp
Bioorganic & medicinal chemistry 12 (24), 6527-6537, 2004
372004
Unimolecular Rate Constants for HX or DX Elimination (X= F, Cl) from Chemically Activated CF3CH2CH2Cl, C2H5CH2Cl, and C2D5CH2Cl: Threshold Energies for HF and HCl Elimination
JD Ferguson, NL Johnson, PM Kekenes-Huskey, WC Everett, GL Heard, ...
The Journal of Physical Chemistry A 109 (20), 4540-4551, 2005
352005
Prediction of the 3D Structure of FMRF‐amide Neuropeptides Bound to the Mouse MrgC11 GPCR and Experimental Validation
J Heo, SK Han, N Vaidehi, J Wendel, P Kekenes‐Huskey, WA Goddard III
Chembiochem 8 (13), 1527-1539, 2007
322007
Computational studies of the effect of the S23D/S24D troponin I mutation on cardiac troponin structural dynamics
Y Cheng, S Lindert, P Kekenes-Huskey, VS Rao, RJ Solaro, PR Rosevear, ...
Biophysical journal 107 (7), 1675-1685, 2014
302014
Molecular Basis of Calcium-Sensitizing and Desensitizing Mutations of the Human Cardiac Troponin C Regulatory Domain: A Multi-Scale Simulation Study
PM Kekenes-Huskey, S Lindert, JA McCammon
PLOS Computational Biology 8 (11), e1002777, 2012
282012
Long-Timescale Molecular Dynamics Simulations Elucidate the Dynamics and Kinetics of Exposure of the Hydrophobic Patch in Troponin C
S Lindert, PM Kekenes-Huskey, JA McCammon
Biophysical Journal 103 (8), 1784-1789, 2012
282012
Influence of neighboring reactive particles on diffusion-limited reactions
C Eun, PM Kekenes-Huskey, JA McCammon
The Journal of chemical physics 139 (4), 07B623_1, 2013
272013
Myofilament calcium sensitivity: consequences of the effective concentration of troponin I
JK Siddiqui, SB Tikunova, SD Walton, B Liu, M Meyer, PP de Tombe, ...
Frontiers in physiology 7, 632, 2016
252016
Modeling Effects of L-Type Ca2+ Current and Na+-Ca2+ Exchanger on Ca2+ Trigger Flux in Rabbit Myocytes with Realistic T-Tubule Geometries
PM Kekenes-Huskey, Y Cheng, JE Hake, FB Sachse, JH Bridge, MJ Holst, ...
Frontiers in Physiology 3, 351, 2012
242012
Quantifying the influence of the crowded cytoplasm on small molecule diffusion
PM Kekenes-Huskey, CE Scott, S Atalay
The Journal of Physical Chemistry B 120 (33), 8696-8706, 2016
232016
Calcium binding and allosteric signaling mechanisms for the sarcoplasmic reticulum Ca2+ ATPase
PM Kekenes‐Huskey, VT Metzger, BJ Grant, J Andrew McCammon
Protein Science 21 (10), 1429-1443, 2012
232012
Multi-core CPU or GPU-accelerated multiscale modeling for biomolecular complexes
T Liao, Y Zhang, PM Kekenes-Huskey, Y Cheng, A Michailova, ...
Computational and Mathematical Biophysics 1 (2013), 164-179, 2013
222013
Electrostatic channeling in P. falciparum DHFR-TS: Brownian dynamics and Smoluchowski modeling
VT Metzger, C Eun, PM Kekenes-Huskey, G Huber, JA McCammon
Biophysical journal 107 (10), 2394-2402, 2014
212014
Molecular and subcellular-scale modeling of nucleotide diffusion in the cardiac myofilament lattice
PM Kekenes-Huskey, T Liao, AK Gillette, JE Hake, Y Zhang, ...
Biophysical journal 105 (9), 2130-2140, 2013
182013
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