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. 2018 Sep 25;9:3908. doi: 10.1038/s41467-018-06400-0

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© The Author(s) 2018

Open Access This article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons license, and indicate if changes were made. The images or other third party material in this article are included in the article’s Creative Commons license, unless indicated otherwise in a credit line to the material. If material is not included in the article’s Creative Commons license and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this license, visit http://creativecommons.org/licenses/by/4.0/.

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Fig. 8 — Atomistic and coarse-grained representation of the Chol-silane molecule. a Full representation of a chiral ligand molecule. b Coarse-grained description of the same ligand molecule, where only 5 of the original 118 atoms were retained: one Si, one S and three C atoms. c GNR1 spherocylindrical nanoparticle decorated with 20 CG Chol-silane ligands randomly distributed. d NP3 quasi-spherical Au nanoparticle bound to the same number of Chol-silane molecules in the Coarse Grained representation