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Integrated network toxicology, molecular docking, and molecular dynamics simulation reveals mechanisms of

Yuxin Pan1, Shuqi Qin2, Cheng Chen1

  • 1Department of Pediatrics, The Third Xiangya Hospital of Central South University, Changsha, Hunan, 410013, China.

BMC Pharmacology & Toxicology
|January 20, 2026
PubMed
Abstract

No abstract available in PubMed .

Keywords:
Benzo[a]pyreneMolecular dockingMolecular dynamicsNetwork toxicologyPan-Cancer

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