Predicting Solvation Free Energies Using Electronegativity-Equalization Atomic Charges and a Dense Neural Network: A Generalized-Born Approach.

J Chem Theory Comput · 2023 · PMC10853938 · PMID 37962524

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hedged sentence

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closest p

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boldest claim

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a clear trendno p-value reported

the majority), with a substantially lower coefficient of determination R ( 2 ) and a clear trend of underestimating |Δ G ° solv |.

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