TY  - JOUR

T1  - Enhancing reaction-based de novo design using a multi-label reaction class recommender

JO  - Journal of Computer-Aided Molecular Design

UR  - https://eprints.whiterose.ac.uk/id/eprint/157407

PY  - 2020/07/01

AU  - Ghiandoni GM

AU  - Bodkin MJ

AU  - Chen B

AU  - Hristozov D

AU  - Wallace JEA

AU  - Webster J

AU  - Gillet VJ

ED  - 

DO  - DOI: 10.1007/s10822-020-00300-6

PB  - Springer

VL  - 34

IS  - 7

SP  - 783

EP  - 803

Y2  - 2025/10/31

ER  -