"Empirically Fitted Parameters for Calculating pKa Values ..."

Annia Galano et al. (2016)

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DOI: 10.1021/ACS.JCIM.6B00310

access: closed

type: Journal Article

metadata version: 2020-10-26

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Annia Galano, Adriana Pérez-González, Romina Castañeda-Arriaga, Leonardo Muñoz-Rugeles, Gabriela Mendoza-Sarmiento, Antonio Romero-Silva, Agustin Ibarra-Escutia, Aida Mariana Rebollar-Zepeda, Jorge Rafael León-Carmona, Manuel Alejandro Hernández-Olivares, Juan Raúl Alvarez-Idaboy:
Empirically Fitted Parameters for Calculating pK_a Values with Small Deviations from Experiments Using a Simple Computational Strategy. J. Chem. Inf. Model. 56(9): 1714-1724 (2016)

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