Abstract
A fully self-consistent 3D Poisson P3M Brownian dynamics solver is used to investigate the role of the long-range electrostatic forces on the selectivity and conductivity of OmpF porin. Our simulations show that even with zero applied bias, the long-range interactions are an important component of the total potential energy. In addition, the long-range force due to mobile carriers is shown to play a role in facilitating the flow of anions through the OmpF channel by screening the effect of the negative fixed charge of the protein.
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Aboud, S., Marreiro, D., Saraniti, M. et al. The Role of Long-Range Forces in Porin Channel Conduction. J Comput Electron 4, 175–178 (2005). https://doi.org/10.1007/s10825-005-7133-6
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DOI: https://doi.org/10.1007/s10825-005-7133-6