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Finite difference Poisson-Boltzmann electrostatic calculations: Increased accuracy achieved by harmonic dielectric smoothing and charge antialiasing.
Robert E. Bruccoleri
Jiri Novotny
Malcolm E. Davis
Kim A. Sharp
Published in:
J. Comput. Chem. (1997)
Keyphrases
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finite difference
gaussian smoothing
finite element
diffusion equation
numerical solution
partial differential equations
numerical analysis
higher order