Issue Date | Title | Author(s) | Source | WOS | Fulltext/Archive link |
2018 | De novo molecular design using deep reinforcement learning methods | Hong-Ming Chen ; Olivercrona, M.; Blaschke, T.; Engkvist, O.; Kogej, T.; Tyrchan, C. | Abstracts of Papers of the American Chemical Society | | |
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 | | |