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A Stochastic Algorithm for the Isobaric-Isothermal Ensemble with Ewald Summations for All Long Range Forces (2015)

First Author: Di Pierro M

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/10.1021/acs.jctc.5b00648

PubMed Identifier: 26616351

Publication URI: http://europepmc.org/abstract/MED/26616351

Type: Journal Article/Review

Parent Publication: Journal of Chemical Theory and Computation

Issue: 12

ISSN: 1549-9618