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Efficient molecular dynamics using geodesic integration and solvent-solute splitting. (2016)

First Author: Leimkuhler B
Attributed to:  SI2-CHE: ExTASY: Extensible Tools for Advanced Sampling and analYsis funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1098/rspa.2016.0138

PubMed Identifier: 27279779

Publication URI: http://europepmc.org/abstract/MED/27279779

Type: Journal Article/Review

Volume: 472

Parent Publication: Proceedings. Mathematical, physical, and engineering sciences

Issue: 2189

ISSN: 1364-5021