Dataset · Hugging Face

kunikohunter/PepBind3D

Name: PepBind3D
Creator: kunikohunter
License: cc-by-4.0
Keywords: task_categories:other, license:cc-by-4.0, size_categories:100K<n<1M, doi:10.57967/hf/10466, region:us, biology, protein-structure, MHC, HLA, peptide, binding-affinity, rosetta, immunology

PepBind3D Curated peptide-HLA class I binding affinities paired with Rosetta FlexPepDock structural ensembles. 112,561 peptide-allele pairs across 95 HLA-A, -B and -C alleles, each with 25 docked decoy structures and per-decoy interface energies. Authors: Kuniko Hunter, Rocco Moretti, Jens Meiler, David G. HarrisonProduced at: Vanderbilt University / Vanderbilt University Medical CenterLicense: CC BY 4.0Metadata source: Immune Epitope Database (IEDB) Dataset Summary… See the full description on the dataset page: https://huggingface.co/datasets/kunikohunter/PepBind3D.

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Author / organization	kunikohunter
License (as declared)	cc-by-4.0
Downloads	616 (as reported by Hugging Face)
Likes	0
Created	3 March 2026
Last updated at source	16 September 2026

biologyprotein-structureMHCHLApeptidebinding-affinityrosettaimmunology

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