Datasets Activity Stream About Order by Relevance Name Ascending Name Descending Last Modified Go 2 datasets found Groups: Chemistry Formats: JSON Filter Results BindingDB The dataset is used for compound-protein binding affinity prediction, and it contains 218,615 compound-protein pairs. Dataset JSON QM9 A dataset of small molecules for benchmarking molecule generation methods. The dataset consists of fingerprints of the molecules, and the goal is to predict the original... Dataset JSON
