This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.
All processed datasets are based on data extracted from ChEMBL, release v25 (Provided under a Creative Commons Attribution-ShareAlike 3.0 Unported license: http://ftp.ebi.ac.uk/pub/databases/chembl/ChEMBLdb/releases/chembl_25/LICENSE)
v25: http://ftp.ebi.ac.uk/pub/databases/chembl/ChEMBLdb/releases/chembl_25/
Reference: Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, Cibrián-Uhalte E, Davies M, Dedman N, Karlsson A, Magariños MP, Overington JP, Papadatos G, Smit I, Leach AR. The ChEMBL database in 2017. Nucleic Acids Res. 2017 45(D1):D945-D954. DOI: 10.1093/nar/gkw1074
All datasets can be found on MELLODDY Zenodo Community:
https://zenodo.org/communities/melloddy/?page=1&size=20
ChEMBL v25 output files extracted and processed with the public data preparation code https://zenodo.org/record/5045055#.YRqAVpMzZTZ
Public data from ChEMBL (version 25) for running MELLODDY-TUNER release v1.0:
https://doi.org/10.5281/zenodo.4778423
Public data from ChEMBL (version 25) and PubChem for running MELLODDY-TUNER release v2.0: