公開日期 | 標題 | 作者 | 來源出版物 | WOS | 全文 |
2018 | Application of Generative Autoencoder in De Novo Molecular Design | Blaschke, T.; Olivecrona, M.; Engkvist, O.; Bajorath, J.; Hong-Ming Chen | Molecular Informatics | | |
2019 | Combining structural and bioactivity-based fingerprints improves prediction performance and scaffold hopping capability | Laufkotter, O.; Sturm, N.; Bajorath, J.; Hong-Ming Chen ; Engkvist, O. | Journal of Cheminformatics | | |
2019 | Identification of Compounds That Interfere with High-Throughput Screening Assay Technologies | David, L.; Walsh, J.; Sturm, N.; Feierberg, I.; Nissink, J. W. M.; Hong-Ming Chen ; Bajorath, J.; Engkvist, O. | Chemmedchem | | |