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. Author manuscript; available in PMC: 2016 Jan 20.
Published in final edited form as: J Chem Inf Model. 2015 Oct 5;55(10):2187–2199. doi: 10.1021/acs.jcim.5b00341

Figure 11. Effect of Implicit Solvent Modeling on Binding Affinity Calculation for P2Y12R.

Figure 11

Correlation plots of computed and measured relative binding free energies (ΔΔG) for P2Y12R complexes.