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Scaffold-based novel SHP2 allosteric inhibitors design using Receptor-Ligand pharmacophore model, virtual screening

Wen-Yan Jin1, Ying Ma1, Wei-Ya Li1

  • 1Tianjin Key Laboratory on Technologies Enabling Development of Clinical Therapeutics and Diagnostics (Theranostics), School of Pharmacy, Tianjin Medical University, Tianjin, China.

Computational Biology and Chemistry
|March 2, 2018
PubMed

Keywords:
ADMETAllosteric inhibitorsCDOCKERMolecular dynamic simulationSBPSHP2

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