Publications

Author Title Type [ Year(Asc)]
Filters: Keyword is Molecular Dynamics Simulation  [Clear All Filters]
2015
Colberg, P. H. ; Kapral, R. . Nanoconfined Catalytic Ångström-Size Motors. Journal of Chemical Physics 2015, 143.PDF icon chemotactic-hydrodynamic-effects-jcp-2017.pdf (3.82 MB)
Robertson, B. ; Kapral, R. . Nanomotor Dynamics In A Chemically Oscillating Medium. Journal of Chemical Physics 2015, 142.
2014
Echeverria, C. ; Kapral, R. . Diffusional Correlations Among Multiple Active Sites In A Single Enzyme. Physical Chemistry Chemical Physics 2014, 16, 6211-6216.PDF icon meso-mult-sites-4ot-pccp-14.pdf (2.44 MB)
2013
Huang, M. - J. ; Kapral, R. ; Mikhailov, A. S. ; Chen, H. - Y. . Coarse-Grain Simulations Of Active Molecular Machines In Lipid Bilayers. Journal of Chemical Physics 2013, 138.PDF icon PDF (464.5 KB)
2012
Huang, M. - J. ; Kapral, R. ; Mikhailov, A. S. ; Chen, H. - Y. . Coarse-Grain Model For Lipid Bilayer Self-Assembly And Dynamics: Multiparticle Collision Description Of The Solvent. Journal of Chemical Physics 2012, 137.PDF icon meso-lipid-jcp-12.pdf (464.5 KB)
Echeverria, C. ; Kapral, R. . Molecular Crowding And Protein Enzymatic Dynamics. Physical Chemistry Chemical Physics 2012, 14, 6755-6763.PDF icon meso-ake-crowd-pccp-12.pdf (430.53 KB)
2011
Chen, J. - X. ; Kapral, R. . Mesoscopic Dynamics Of Diffusion-Influenced Enzyme Kinetics. Journal of Chemical Physics 2011, 134.PDF icon meso-enzyme-kinetics-jcp-11.pdf (884.6 KB)
Echeverria, C. ; Togashi, Y. ; Mikhailov, A. S. ; Kapral, R. . A Mesoscopic Model For Protein Enzymatic Dynamics In Solution. Physical Chemistry Chemical Physics 2011, 13, 10527-10537.PDF icon meso_ake-pccp-2011.pdf (1.89 MB)
2010
Echeverria, C. ; Kapral, R. . Macromolecular Dynamics In Crowded Environments. Journal of Chemical Physics 2010, 132.PDF icon meso-polymer-crowd-jcp-2010.pdf (785.99 KB)