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. Author manuscript; available in PMC: 2015 Apr 20.
Published in final edited form as: J Comput Chem. 2013 Jan 7;34(11):893–903. doi: 10.1002/jcc.23199

Figure 2.

Figure 2

Average unsigned errors of hydration free energies by chemical class for four different parameterization schemes in the GBMV2 implicit solvent model for the A) 82 molecules that are in CGENFF and B) the 375 compounds that are not included in CGENFF.