Complete instructions for running OpenChemIE can be found at this github repository.
Additionally, the web interface is located at
https://mit.openchemie.info/.
The images associated with the annotated dataset for R-group resolution can be downloaded here and the annotations are located at
r_group_resolution_data.json.
The annotations take the following format:
[
{
"file_name": "acs.joc.2c00176 example 1.png",
"reaction_template": {
"reactants": [… See the full description on the dataset page:
https://huggingface.co/datasets/Ozymandias314/OpenChemIEData.
