graphs-datasets/ZINC
Dataset Card for ZINC Dataset Summary The ZINC dataset is a "curated collection of commercially available chemical compounds prepared especially for virtual screening" (Wikipedia). Supported Tasks and Leaderboards ZINC should be used for molecular property prediction (aiming to predict the constrained solubility of the molecules), a graph regression task. The score used is the MAE. The associated leaderboard is here: Papers with code leaderboard.… See the full description on the dataset page: https://huggingface.co/datasets/graphs-datasets/ZINC.
| Author / organization | graphs-datasets |
|---|---|
| License (as declared) | unknown |
| Downloads | 478 (as reported by Hugging Face) |
| Likes | 6 |
| Created | 1 August 2022 |
| Last updated at source | 7 February 2023 |
Popularity, last 2 days
478 now (+4 since 2026-10-16). Counts as reported by the source, snapshotted daily by Silytics.
More from graphs-datasets
- graphs-datasets/MUTAGDataset
- graphs-datasets/CIFAR10Dataset
- graphs-datasets/AIDSDataset
- graphs-datasets/AQSOLDataset
- graphs-datasets/CSLDataset
- graphs-datasets/MNISTDataset
Silytics shows public metadata from Hugging Face and links to the original. Information may be incomplete or out of date. Last refreshed 17 October 2026. Licenses and terms of the original apply to the work itself. Not financial, legal or professional advice.