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Tobias Hüfner-Wulsdorf, Gerhard Klebe. Advancing GIST-Based Solvent Functionals through Multiobjective Optimization of Solvent Enthalpy and Entropy Scoring Terms. Journal of Chemical Information and Computer Sciences, 60(12):6654-6665, 2020. [doi]
Possibly Related PublicationsThe following publications are possibly variants of this publication: Protein-Ligand Complex Solvation Thermodynamics: Development, Parameterization, and Testing of GIST-Based Solvent FunctionalsTobias Hüfner-Wulsdorf, Gerhard Klebe. jcisd, 60(3):1409-1423, 2020. [doi]
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