FEP+/OpenFE binding affinity benchmark
Binding affinity prediction (Pearson correlation)
domain
Definition
- Version
- not in the notes
- Category
- domain
- Maintainer
- not in the notes
- Status
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- Home page
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Sources
- intuitionlabs.ai/articles/open-source-ai-drug-discovery-boltz-... https://intuitionlabs.ai/articles/open-source-ai-drug-discovery-boltz-pfizer
Scores
| Model | Score | Who ran it | Setting | View or population | Date | Source |
|---|---|---|---|---|---|---|
 Boltz-2 | 0.62 Pearson r | vendor-reported | About 0.62; about 1,000x faster than FEP | – | Jun 2025 | intuitionlabs.ai |
Where this comes from
Scores from different settings, harnesses or dates are not directly comparable; the row says which. Sorted by score, highest first, as a reading aid, not a ranking.
To cite this page: Project AURION, AI Use-Cases Research & Innovation, "FEP+/OpenFE Binding Affinity Benchmark", https://aurion.semai.id/benchmarks/fep-plus-openfe/, records of October 2026.