Hake, J. ., Kekenes-Huskey, P. ., & McCulloch, A. . (2014). Computational modeling of subcellular transport and signaling. Current Opinion in Structural Biology, 25, 92-7. https://doi.org/10.1016/j.sbi.2014.01.006
PM Kekenes-Huskey
First name:
PM
Last name:
Kekenes-Huskey
Liao, T. ., Zhang, Y. ., Kekenes-Huskey, P. ., Cheng, Y. ., Michailova, A. ., McCulloch, A. ., … McCammon, J. . (2013). Multi-core CPU or GPU-accelerated Multiscale Modeling for Biomolecular Complexes. Molecular Based Mathematical Biology (Online), 1. https://doi.org/10.2478/mlbmb-2013-0009
Kekenes-Huskey, P. ., Liao, T. ., Gillette, A. ., Hake, J. ., Zhang, Y. ., Michailova, A. ., … McCammon, J. . (2013). Molecular and subcellular-scale modeling of nucleotide diffusion in the cardiac myofilament lattice. Biophysical Journal, 105(9), 2130-40. https://doi.org/10.1016/j.bpj.2013.09.020 (Original work published 2013)
Eun, C. ., Kekenes-Huskey, P. ., & McCammon, J. . (2013). Influence of neighboring reactive particles on diffusion-limited reactions. The Journal of Chemical Physics, 139(4), 044117. https://doi.org/10.1063/1.4816522 (Original work published 2013)
Kekenes-Huskey, P. ., Gillette, A. ., Hake, J. ., & McCammon, J. . (2012). Finite Element Estimation of Protein-Ligand Association Rates with Post-Encounter Effects: Applications to Calcium binding in Troponin C and SERCA. Computational Science & Discovery, 5. https://doi.org/10.1088/1749-4699/5/1/014015 (Original work published 2012)
Kekenes-Huskey, P. ., Lindert, S. ., & McCammon, J. . Molecular basis of calcium-sensitizing and desensitizing mutations of the human cardiac troponin C regulatory domain: a multi-scale simulation study. PLoS Computational Biology, 8(11), e1002777. https://doi.org/10.1371/journal.pcbi.1002777 (Original work published 2012)
Lindert, S. ., Kekenes-Huskey, P. ., & McCammon, J. . (2012). Long-timescale molecular dynamics simulations elucidate the dynamics and kinetics of exposure of the hydrophobic patch in troponin C. Biophysical Journal, 103(8), 1784-9. https://doi.org/10.1016/j.bpj.2012.08.058 (Original work published 2012)
Kekenes-Huskey, P. ., Gillette, A. ., & McCammon, J. . (2014). Predicting the influence of long-range molecular interactions on macroscopic-scale diffusion by homogenization of the Smoluchowski equation. The Journal of Chemical Physics, 140(17), 174106. https://doi.org/10.1063/1.4873382 (Original work published 2014)
Kekenes-Huskey, P. ., Metzger, V. ., Grant, B. ., & McCammon, A. . (2012). Calcium binding and allosteric signaling mechanisms for the sarcoplasmic reticulum Ca²+ ATPase. Protein Science : A Publication of the Protein Society, 21(10), 1429-43. https://doi.org/10.1002/pro.2129
Hake, J. ., Edwards, A. ., Yu, Z. ., Kekenes-Huskey, P. ., Michailova, A. ., McCammon, J. ., … McCulloch, A. . (2012). Modelling cardiac calcium sparks in a three-dimensional reconstruction of a calcium release unit. The Journal of Physiology, 590(18), 4403-22. https://doi.org/10.1113/jphysiol.2012.227926 (Original work published 2012)