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. 2018 Mar 16;10:15. doi: 10.1186/s13321-018-0264-0

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© The Author(s) 2018

Open AccessThis article is distributed under the terms of the Creative Commons Attribution 4.0 International License (http://creativecommons.org/licenses/by/4.0/), which permits unrestricted use, distribution, and reproduction in any medium, provided 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 Creative Commons Public Domain Dedication waiver (http://creativecommons.org/publicdomain/zero/1.0/) applies to the data made available in this article, unless otherwise stated.

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Fig. 3 — Interactions in binding sites of proteins with good interaction fingerprint performance. Representative complexes for a NA (1a4 g@pdb), b HMGR (1hw8@pdb), c thrombin (1ba8@pdb), d EGFR [overlay of 1m17 with ligands from 1m17 (orange), 1ax9 (blue), 2rgp (purple), 3bel (green) and 4g5j (red)], e COX-2 (1cx2@pdb) and f PR (1sr7@pdb)