Items where authors include "Bodkin, M.J."

Article

Gillet, V. orcid.org/0000-0002-8403-3111, Ghiandoni, G.M., Flanagan, S. et al. (11 more authors) (2024) Synthetically accessible de novo design using reaction vectors: application to PARP1 inhibitors. Molecular Informatics. e202300183. ISSN 1868-1743

Ghiandoni, G.M., Bodkin, M.J., Chen, B. et al. (4 more authors) (2022) RENATE : a pseudo-retrosynthetic tool for synthetically accessible de novo design. Molecular Informatics, 41 (4). 2100207. ISSN 1868-1743

Ghiandoni, G.M., Bodkin, M.J., Chen, B. et al. (4 more authors) (2020) Enhancing reaction-based de novo design using a multi-label reaction class recommender. Journal of Computer-Aided Molecular Design, 34 (7). pp. 783-803. ISSN 0920-654X

Ghiandoni, G.M., Bodkin, M.J., Chen, B. et al. (4 more authors) (2019) Development and application of a data-driven reaction classification model : comparison of an electronic lab notebook and the medicinal chemistry literature. Journal of Chemical Information and Modeling, 59 (10). pp. 4167-4187. ISSN 1549-9596