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George Mason University

Docking a Metal Nanoparticle to a Protein Surface

Abstract

This thesis develops a mathematical and computational methodology for modeling electrostatic interactions between a spherical electrode and the photosynthetic reaction center (PRC) of the Rhodobacter Sphaeroides bacteria. A PRC is a protein-pigment complex capable of photosynthetic reaction, converting light energy into chemical energy. Recent studies suggest it is possible to use PRCs in the construction of next generation photovoltaic devices. Modeling the electrostatic interactions between an electrode and a PRC to find a position that optimizes electron transfer could improve efficiency of technologies that use PRCs to generate electric current. The position is found by minimizing the total electrostatic energy of the PRC-electrode complex. The resulting nonlinear optimization problem can be solved reliably using a Sequential Quadratic Programming algorithm. The model will provide the PRC-electrode structure even as the problem grows in scope. It can be used as a tool for designing future technologies that take advantage of direct electron transfer between electrodes and proteins.

Author and committee

dc:creator, dc:contributor.*
Author
  • Perkins, Jonathan

Subjects

dc:subject × 5

Identifiers

dc:identifier.*
Identifier
hdl:1920/9140
OAI identifier oai:identifier
oai:MARS:1920/9140

Chain of custody

source
Harvested from
George Mason University
Base URL
mars.gmu.edu/server/oai/request
Last updated
2026-07-27
Source record
OAI-PMH GetRecord
citation

Perkins, Jonathan. Docking a Metal Nanoparticle to a Protein Surface. 2015.