Discovery of Potential Orthosteric and Allosteric Antagonists of P2Y1R from Chinese Herbs by Molecular Simulation Methods

<div>The optimal pharmacophore model (Model O-01) of orthosteric antagonist. Cyan indicates hydrophobic features, green indicates hydrogen bond acceptors, and purple indicates hydrogen bond donors.</div>

Evidence-Based Complementary and Alternative Medicine

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Figure 5

Figure 5: Discovery of Potential Orthosteric and Allosteric Antagonists of P2Y1R from Chinese Herbs by Molecular Simulation Methods 