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ref. 1. https://pubs.acs.org/doi/10.1021/acs.jcim.8b00545, benchmark data available at http://www.pdbbind.org.cn/index.php, used for comparability with prior results
2. https://www.pharmchem.uni-tuebingen.de/dekois/, "DEKOIS 2.0: Demanding Evaluation Kits for Objective In silico Screening"
ref. 1. TDC.Solubility_AqSolDB
2. Ulrich N., Goss K. U., Ebert A. Exploring the octanol–water partition coefficient dataset using deep learning techniques and data augmentation // Communications Chemistry. – 2021. – Т. 4. – №. 1. – С. 90.
3. TDC.Lipophilicity_AstraZeneca
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