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. 2015 Sep 24;5:14358. doi: 10.1038/srep14358

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Copyright © 2015, Macmillan Publishers Limited

This work is licensed under a Creative Commons Attribution 4.0 International License. The images or other third party material in this article are included in the article’s Creative Commons license, unless indicated otherwise in the credit line; if the material is not included under the Creative Commons license, users will need to obtain permission from the license holder to reproduce the material. To view a copy of this license, visit http://creativecommons.org/licenses/by/4.0/

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The (R_OO, θ) and (R_OO, φ) contour maps of the oxygen atom population within the second-shell RDF peak (R_OO ≤ 4.5 Å) and the (θ, φ) contour map within the first shell (R_OO ≤ 3.4 Å). R_OO, θ, and φ are spherical coordinates as defined above. D and A stand for the hydrogen-donating (H-donor) and accepting (H-acceptor) water molecules, respectively.