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Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).
The performance of miDruglikeness models on the internal test set and the low similarity test set, the error bar is the standard deviation of testing results in five-fold training. (a) In vivo ability model; (b) IND ability model; (c) market approvability model.