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Chemical Science

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Edge Article

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

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Corresponding authors
a
Department of Chemical Engineering, University College London, London, UK
E-mail: ozgur.yazaydin@ucl.ac.uk
b
Department of Chemistry and Applied Biosciences, ETH Zurich, Zurich, Switzerland
c
Institute of Computational Science, Università della Svizzera Italiana, Lugano, Switzerland
Chem. Sci., 2017, Advance Article

DOI: 10.1039/C6SC04978H
Received 10 Nov 2016, Accepted 17 Mar 2017
First published online 20 Mar 2017
Open Access
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