Dataset Details
Dataset Description
The open reaction database is a database of chemical reactions and their conditions
BibTeX:
@article{Kearnes_2021,
doi = {10.1021/jacs.1c09820},
url = {
https://doi.org/10.1021%2Fjacs.1c09820},
year = 2021,
month = {nov},
publisher = {American Chemical Society ({ACS})},
volume = {143},
number = {45},
pages =… See the full description on the dataset page:
https://huggingface.co/datasets/jablonkagroup/ord_predictions.