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Title:
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Numerical Study of the Poisson-Boltzmann Equation for Biomolecular Electrostatics |
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Author:
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Tan, Lian Hing; Lim, Kian Meng; White, Jacob K. |
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Issue Date:
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2006-01 |
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Abstract:
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Electrostatics interaction plays a very important role in almost all biomolecular systems. The Poisson-Boltzmann equation is widely used to treat this electrostatic effect in an ionic solution. In this work, a simple mixed discrete-continuum model is considered and boundary element method is used to solve for the solution. |
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URI:
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http://hdl.handle.net/1721.1/30372
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Series/Report no.:
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High Performance Computation for Engineered Systems (HPCES) |
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Keywords:
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Boundary Element Method, Biomolecular electrostatics, Poisson-Boltzmann Equation |
