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Simcyp Validation Sets

PBPK validation datasets used by Simcyp/Certara community (DDI, pediatric, renal impairment).
Composite score: 74.4

Rubric (1–5 per criterion)

rigor
4/5
coverage
3/5
maintenance
4/5
adoption
4/5
quality
4/5
accessibility
2/5
industry_relevance
5/5

Metadata

Stages
Phase IPhase IIIND-enabling
Modalities
small-molecule
Task types
pbpk-validation
License
Proprietary
First release
2001
Last updated
2024
Flags
license-gated-commercial

Size & scope

Primary paper

Title
Physiologically based pharmacokinetic modeling: Methods and applications in pharmacotherapy
Authors
Rostami-Hodjegan A, Tucker GT
Year
2007
DOI / arXiv
10.1038/nrd2173
Citations
780

Links

Hosted by (initiatives)

Experts (primary authors / maintainers)

Groups (host labs / companies / consortia)

Related benchmarks

Notes (honest caveats)

Industry gold standard but proprietary. Open benchmarks exist via OSP Suite.