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Bardhan, 2009 - Google Patents

Numerical solution of boundary-integral equations for molecular electrostatics

Bardhan, 2009

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Document ID
541921905605111256
Author
Bardhan J
Publication year
Publication venue
The Journal of chemical physics

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Numerous molecular processes, such as ion permeation through channel proteins, are governed by relatively small changes in energetics. As a result, theoretical investigations of these processes require accurate numerical methods. In the present paper, we evaluate the …
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    • G06F17/10—Complex mathematical operations
    • G06F17/11—Complex mathematical operations for solving equations, e.g. nonlinear equations, general mathematical optimization problems
    • G06F17/13—Differential equations
    • G—PHYSICS
    • G06—COMPUTING; CALCULATING; COUNTING
    • G06F—ELECTRICAL DIGITAL DATA PROCESSING
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