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Paper · arXiv

PepBenchmark: A Standardized Benchmark for Peptide Machine Learning

Peptide therapeutics are widely regarded as the "third generation" of drugs, yet progress in peptide Machine Learning (ML) are hindered by the absence of standardized benchmarks. Here we present PepBenchmark, which unifies datasets, preprocessing, and evaluation protocols for peptide drug discovery. PepBenchmark comprises three components: (1) PepBenchData, a well-curated collection comprising 29 canonical-peptide and 6 non-canonical-peptide datasets across 7 groups, systematically covering key aspects of peptide drug development, representing, to the best of our knowledge, the most comprehensive AI-ready dataset resource to date; (2) PepBenchPipeline, a standardized preprocessing pipelin...

AuthorsJiahui Zhang, Rouyi Wang, Kuangqi Zhou et al.
Primary categorycs.LG
Published12 April 2026
Last updated at source12 April 2026
cs.LGcs.AI
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