Balancing an accurate representation of the molecular surface in generalized born formalisms with integrator stability in molecular dynamics simulations

Jana Chocholousová, Michael Feig. Balancing an accurate representation of the molecular surface in generalized born formalisms with integrator stability in molecular dynamics simulations. Journal of Computational Chemistry, 27(6):719-729, 2006. [doi]

Authors

Jana Chocholousová

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Michael Feig

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