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 Comparative assessment of the direct and isodesmic methods for pKa calculation of monocarboxylic acids using density functional theory |
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Felipe Ribeiro Dutra, Rogério Custodio, Comparative assessment of the direct and isodesmic methods for pKa calculation of monocarboxylic acids using density functional theory, Computational and Theoretical Chemistry, Volume 1237, 2024, 114629, ISSN 2210-271X, |
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(2025-6-4)
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