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. 2022 Jun 20;5:610. doi: 10.1038/s42003-022-03562-y

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© The Author(s) 2022

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. 4 — The average best-match RMSDs of 100-fold diluted test sets of (a) Q15 and (b) Aβ40, against generated sets at different sizes. The latter sizes are measured in multiples of the test size of each IDP (= 85,500 for Q15 and 112,000 for Aβ40). For run1, results are shown at sizes of the generated set ranging from the training size to 4×. For other MD runs, results are shown at 1×. In the inset of each panel, an IDP conformation and its generated best match, with an RMSD close to the average values at 1×, is compared.