| Title | Machine learning of reaction properties via learned representations of the condensed graph of reaction |
| Publication Type | Journal Article |
| Year of Publication | 2021 |
| Authors | Heid E, Green WH |
| Journal | Journal of Chemical Information and Modeling |
| Issue | Special Issue: From Reaction Informatics to Chemical Space |
| URL | https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.1c00975 |
| DOI | 10.1021/acs.jcim.1c00975 |
Green Research Group
Fundamental and Applied Chemical Kinetics
