LRGB/PCQM-Contact
peptides-functional Dataset Summary Dataset Domain Task Node Feat. (dim) Edge Feat. (dim) Perf. Metric PCQM-Contact Quantum Chemistry Link Prediction Atom Encoder (9) Bond Encoder (3) Hits@K, MRR Dataset # Graphs # Nodes μ Nodes μ Deg. # Edges μ Edges μ Short. Path μ Diameter PCQM-Contact 529,434 15,955,687 30.14 2.03 32,341,644 61.09 4.63±0.63 9.86±1.79 Additional Information Dataset Curators Vijay… See the full description on the dataset page: https://huggingface.co/datasets/LRGB/PCQM-Contact.
| Author / organization | LRGB |
|---|---|
| License (as declared) | cc-by-4.0 |
| Downloads | 272 (as reported by Hugging Face) |
| Likes | 0 |
| Created | 16 February 2023 |
| Last updated at source | 17 February 2023 |
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- 16 Oct 2026 Description: peptides-functional Dataset Summary Dataset Domain Task Node Feat. (dim) Edge Feat. (dim) Perf. Metric PCQM-Contact Quantum Chemistry Link Prediction Atom Encoder (9) Bond Encoder (3) Hits@K, MRR Dataset # Graphs # Nodes μ Nodes μ Deg. # Ed → peptides-functional Dataset Summary Dataset Domain Task Node Feat. (dim) Edge Feat. (dim) Perf. Metric PCQM-Contact Quantum Chemistry Link Prediction Atom Encoder (9) Bond Encoder (3) Hits@K, MRR Dataset # Graphs # Nodes μ Nodes μ Deg. # Ed
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