Concentration gradient driven molecular dynamics: a new method for simulations of membrane permeation and separation

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Authors: Aydin Ozcan, Claudio Perego, Matteo Salvalaglio, Michele Parrinello, Ozgur Yazaydin

Journal title: Chem. Sci.

Journal number: 8/5

Journal publisher: Royal Society of Chemistry

Published year: 2017

Published pages: 3858-3865

DOI identifier: 10.1039/C6SC04978H

ISSN: 2041-6520