open-reaction-database / ord-data

Official data repository for the Open Reaction Database
https://open-reaction-database.org
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Add Baumgartner et al. Suzuki reaction dataset #165

Closed marcosfelt closed 2 weeks ago

marcosfelt commented 1 year ago

Added a dataset for the reaction optimization from this paper: https://pubs.rsc.org/en/content/articlelanding/2018/RE/C8RE00032H

Code used to generate dataset is here: https://github.com/sustainable-processes/multitask/blob/69606a102b981bf2c207efd72741503fc4a349e3/multitask/etl/etl_baumgartner_suzuki.py

skearnes commented 1 year ago

These reactions seem to be missing provenance---maybe you need to add a new commit after updating the code?

skearnes commented 2 weeks ago

@marcosfelt I'm closing this due to inactivity.