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. Author manuscript; available in PMC: 2021 Jul 16.
Published in final edited form as: J Chem Inf Model. 2020 Oct 29;60(12):6065–6073. doi: 10.1021/acs.jcim.0c00675

Figure 1. Feature trees capture pharmacophores in a “fuzzy” fashion that cannot distinguish atomic-level detail.

Figure 1.

By contrast, searches in SmallWorld and Arthor are atomic and can match precise atom patterns, allowing for finer discrimination at scale.