Dataset Overview

Dataset Source

• All processed datasets are derived from the ChEMBL database version 25.
• The original data and license information for ChEMBL v25 can be obtained from the following link: ChEMBL v25.

Dataset Content

ChEMBL‑related Datasets

• The dataset is extracted and processed from the ChEMBL v25 output files; processing code is publicly available: Data Processing Code.

MELLODDY‑TUNER‑related Datasets

Version 1.0

• Public data for running MELLODDY‑TUNER v1.0 originates from ChEMBL (version 25): MELLODDY‑TUNER v1.0.

Version 2.0

• Public data for running MELLODDY‑TUNER v2.0 comes from ChEMBL (version 25) and PubChem: MELLODDY‑TUNER v2.0.

Dataset License

• This dataset follows the Creative Commons Attribution‑ShareAlike 4.0 International License.