Lee G. Pedersen

Particle mesh Ewald: An <i>N</i>⋅log(<i>N</i>) method for Ewald sums in large systems

Tom Darden, Darrin M. York, Lee G. Pedersen · The Journal of Chemical Physics · 1993 · 30.7K citations · Full text

Natural Sciences, Chemistry, Physics +13

A smooth particle mesh Ewald method

Ulrich Essmann, L. Perera, Max L. Berkowitz et al. · The Journal of Chemical Physics · 1995 · 22.9K citations

Natural Sciences, Chemistry, Biomolecular Modeling +13

The effect of long-range electrostatic interactions in simulations of macromolecular crystals: A comparison of the Ewald and truncated list methods

Darrin M. York, Tom Darden, Lee G. Pedersen · The Journal of Chemical Physics · 1993 · 773 citations

Natural Sciences, Biochemistry, Biophysics +17

Gene selection for sample classification based on gene expression data: study of sensitivity to choice of parameters of the GA/KNN method

Leping Li, Clarice R. Weinberg, Thomas A. Darden et al. · Bioinformatics · 2001 · 649 citations · Full text

Life Sciences, Bioinformatics, Biostatistics +16

Towards an accurate representation of electrostatics in classical force fields: Efficient implementation of multipolar interactions in biomolecular simulations

Celeste Sagui, Lee G. Pedersen, Thomas A. Darden · The Journal of Chemical Physics · 2003 · 225 citations

Natural Sciences, Biophysics, Physics +17