公開日期 | 標題 | 作者 | 來源出版物 | WOS | 全文 |
2019 | Exploring the GDB-13 chemical space using deep generative models | Arus-Pous, J.; Blaschke, T.; Ulander, S.; Reymond, J. L.; Hong-Ming Chen ; Engkvist, O. | Journal of Cheminformatics | | |
2019 | Randomized SMILES strings improve the quality of molecular generative models | Arus-Pous, J.; Johansson, S. V.; Prykhodko, O.; Bjerrum, E. J.; Tyrchan, C.; Reymond, J. L.; Hong-Ming Chen ; Engkvist, O. | Journal of Cheminformatics | | |
2020 | SMILES-based deep generative scaffold decorator for de-novo drug design | Arus-Pous, J.; Patronov, A.; Bjerrum, E. J.; Tyrchan, C.; Reymond, J. L.; Hong-Ming Chen ; Engkvist, O. | Journal of Cheminformatics | | |