Brownian Dynamics Simulations of Biological Molecules von Huber, Gary A, McCammon, J Andrew

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Browndye: A software package for Brownian dynamics von Huber, Gary A., McCammon, J. Andrew

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A Stochastic Multiscale Model of Cardiac Thin Filament Activation Using Brownian-Langevin Dynamics von Aboelkassem, Yasser, McCabe, Kimberly J., Huber, Gary A., Regnier, Michael, McCammon, J. Andrew, McCulloch, Andrew D.

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Multiscale modeling shows how 2'-deoxy-ATP rescues ventricular function in heart failure von Teitgen, Abigail E, Hock, Marcus T, McCabe, Kimberly J, Childers, Matthew C, Huber, Gary A, Marzban, Bahador, Beard, Daniel A, McCammon, J Andrew, Regnier, Michael, McCulloch, Andrew D

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Multiscale computational modeling of the effects of 2’-deoxy-ATP on cardiac muscle calcium handling von Hock, Marcus T., Teitgen, Abigail E., McCabe, Kimberly J., Hirakis, Sophia P., Huber, Gary A., Regnier, Michael, Amaro, Rommie E., McCammon, J. Andrew, McCulloch, Andrew D.

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Electrostatic Steering Accelerates C3d:CR2 Association von Mohan, Rohith R, Huber, Gary A, Morikis, Dimitrios

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Brownian dynamic study of an enzyme metabolon in the TCA cycle: Substrate kinetics and channeling von Huang, Yu‐ming M., Huber, Gary A., Wang, Nuo, Minteer, Shelley D., McCammon, J. Andrew

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Channeling by Proximity: The Catalytic Advantages of Active Site Colocalization Using Brownian Dynamics von Bauler, Patricia, Huber, Gary, Leyh, Thomas, McCammon, J. Andrew

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Predicting the effects of dATP on cardiac contraction using multiscale modeling of the sarcomere von McCabe, Kimberly J., Aboelkassem, Yasser, Teitgen, Abigail E., Huber, Gary A., McCammon, J. Andrew, Regnier, Michael, McCulloch, Andrew D.

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Investigating Intrinsically Disordered Proteins With Brownian Dynamics von Ahn, Surl-Hee, Huber, Gary A, McCammon, J Andrew

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Dynamics and Calcium Association to the N-Terminal Regulatory Domain of Human Cardiac Troponin C: A Multiscale Computational Study von Lindert, Steffen, Kekenes-Huskey, Peter M, Huber, Gary, Pierce, Levi, McCammon, J. Andrew

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Assessing the two-body diffusion tensor calculated by the bead models von Wang, Nuo, Huber, Gary A, McCammon, J Andrew

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Solvation Effect on the Conformations of Alanine Dipeptide: Integral Equation Approach von Ishizuka, Ryosuke, Huber, Gary A, McCammon, J. Andrew

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Electrodiffusion: A continuum modeling framework for biomolecular systems with realistic spatiotemporal resolution von Lu, Benzhuo, Zhou, Y. C., Huber, Gary A., Bond, Stephen D., Holst, Michael J., McCammon, J. Andrew

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Hybrid finite element and Brownian dynamics method for diffusion-controlled reactions von Bauler, Patricia, Huber, Gary A., McCammon, J. Andrew

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Electrostatically biased binding of kinesin to microtubules von Grant, Barry J, Gheorghe, Dana M, Zheng, Wenjun, Alonso, Maria, Huber, Gary, Dlugosz, Maciej, McCammon, J Andrew, Cross, Robert A

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Brownian dynamics study of the association between the 70S ribosome and elongation factor G von Długosz, Maciej, Huber, Gary A., McCammon, J. Andrew, Trylska, Joanna

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Hybrid finite element and Brownian dynamics method for charged particles von Huber, Gary A., Miao, Yinglong, Zhou, Shenggao, Li, Bo, McCammon, J. Andrew

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A Computational Assay that Explores the Hemagglutinin/Neuraminidase Functional Balance Reveals the Neuraminidase Secondary Site as a Novel Anti-Influenza Target von Amaro, Rommie E, Ieong, Pek U, Huber, Gary, Dommer, Abigail, Steven, Alasdair C, Bush, Robin M, Durrant, Jacob D, Votapka, Lane W

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Continuum Simulations of Acetylcholine Consumption by Acetylcholinesterase:  A Poisson−Nernst−Planck Approach von Zhou, Y. C, Lu, Benzhuo, Huber, Gary A, Holst, Michael J, McCammon, J. Andrew

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