SandboxAQ/SAIR
Announcing SAIR Structurally-Augmented IC50 Repository In collaboration with Nvidia The Largest Publicly Available Binding Affinity Dataset with Cofolded 3D Structures SAIR (Structurally Augmented IC50 Repository), is the largest public dataset of protein--ligand 3D structures paired with binding potency measurements. SAIR contains over one million protein--ligand complexes (1,048,857 unique pairs) and a total of 5.2 million 3D structures, curated from the ChEMBL… See the full description on the dataset page: https://huggingface.co/datasets/SandboxAQ/SAIR.
| Author / organization | SandboxAQ |
|---|---|
| License (as declared) | cc-by-4.0 |
| Downloads | 786 (as reported by Hugging Face) |
| Likes | 57 |
| Created | 22 August 2025 |
| Last updated at source | 7 April 2026 |
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- 16 Oct 2026 Description: Announcing SAIR Structurally-Augmented IC50 Repository In collaboration with Nvidia The Largest Publicly Available Binding Affinity Dataset with Cofolded 3D Structures SAIR (Structurally Augmented IC50 Repository), is the largest public dat → Announcing SAIR Structurally-Augmented IC50 Repository In collaboration with Nvidia The Largest Publicly Available Binding Affinity Dataset with Cofolded 3D Structures SAIR (Structurally Augmented IC50 Repository), is the largest public dat
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