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The article

Methods To Improve the Calculations of Solvation Model Density Solvation Free Energies and Associated Aqueous pKa Values: Comparison between Choosing an Optimal Theoretical Level, Solute Cavity Scaling, and Using Explicit Solvent Molecules

Longkun Xu, Michelle L. Coote

Rank
39 of 1,126
Percentile
top 3.5%
Where
The Journal of Physical Chemistry A, 2019
Citations
60

From the 2019 list, OpenAlex counts as of 2026-10-29.

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