Staggered Mesh Ewald: An Extension of the Smooth Particle-Mesh Ewald Method Adding Great Versatility-Reference-Cited by-同舟云学术

Staggered Mesh Ewald: An Extension of the Smooth Particle-Mesh Ewald Method Adding Great Versatility

Published:2009-08-04 Issue:9 Volume:5 Page:2322-2338
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Cerutti David S.¹,Duke Robert E.¹,Darden Thomas A.¹,Lybrand Terry P.¹

Affiliation:

1. Center for Structural Biology, Department of Chemistry, Vanderbilt University, 5142 Medical Research Building III, 465 21st Avenue South, Nashville, Tennessee 37232-8725, Department of Chemistry, University of North Carolina, Campus Box 3290, Chapel Hill, North Carolina 27599-0001, Laboratory of Structural Biology, National Institute of Environmental Health Science, Research Triangle Park, 12 Davis Drive, Chapel Hill, North Carolina 27709-5900, and Open Eye Scientific Software, 9 Bisbee Court, Suite D,...

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct9001015

Reference37 articles.

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4. A severe artifact in simulation of liquid water using a long cut-off length: Appearance of a strange layer structure

5. Molecular Dynamics Simulations of Lipid Bilayers: Major Artifacts Due to Truncating Electrostatic Interactions

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