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. 2018 Dec 31;19(Suppl 19):526. doi: 10.1186/s12859-018-2523-5

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© The Author(s) 2018

Open Access This 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. 6 — Examples of learned filters and chemical motifs for the NR-AR subdataset. a Filter 61 and corresponding chemical motifs on different compounds. b Filter 0 and corresponding chemical motifs on different compounds. c Filter 2 and corresponding chemical motifs on different compounds