R-group replacement database for medicinal chemistry.

Kosuke TakeuchiRyo KunimotoJürgen Bajorath

Published in: Future science OA (2021)

The searchable database has no limitations and can easily be modified using the source data we provide. The next step will be applying this R-group resource in practical medicinal chemistry projects as decision support.

Keyphrases

adverse drug
drug discovery
electronic health record
big data
quality improvement
emergency department
machine learning