The System of Self-Consistent Models: The Case of Henry's Law Constants.

Toropov, Andrey A; Toropova, Alla P; Roncaglioni, Alessandra; Benfenati, Emilio; Leszczynska, Danuta; Leszczynski, Jerzy

Toropov, Andrey A; Toropova, Alla P; Roncaglioni, Alessandra; Benfenati, Emilio; Leszczynska, Danuta; Leszczynski, Jerzy.

Afiliación

Toropov AA; Laboratory of Environmental Chemistry and Toxicology, Department of Environmental Health Science, Istituto di Ricerche Farmacologiche Mario Negri IRCCS, Via Mario Negri 2, 20156 Milano, Italy.
Toropova AP; Laboratory of Environmental Chemistry and Toxicology, Department of Environmental Health Science, Istituto di Ricerche Farmacologiche Mario Negri IRCCS, Via Mario Negri 2, 20156 Milano, Italy.
Roncaglioni A; Laboratory of Environmental Chemistry and Toxicology, Department of Environmental Health Science, Istituto di Ricerche Farmacologiche Mario Negri IRCCS, Via Mario Negri 2, 20156 Milano, Italy.
Benfenati E; Laboratory of Environmental Chemistry and Toxicology, Department of Environmental Health Science, Istituto di Ricerche Farmacologiche Mario Negri IRCCS, Via Mario Negri 2, 20156 Milano, Italy.
Leszczynska D; Interdisciplinary Nanotoxicity Center, Department of Civil and Environmental Engineering, Jackson State University, 1325 Lynch Street, Jackson, MS 39217-0510, USA.
Leszczynski J; Interdisciplinary Nanotoxicity Center, Department of Chemistry, Physics and Atmospheric Sciences, Jackson State University, 1400 J. R. Lynch Street, Jackson, MS 39217-0510, USA.

Molecules ; 28(20)2023 Oct 23.

Article en En | MEDLINE | ID: mdl-37894710

Palabras clave

CORAL software; Henry's law constant; Monte Carlo method; QSPR; SMILES; system of self-consistent models

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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: Molecules Asunto de la revista: BIOLOGIA Año: 2023 Tipo del documento: Article País de afiliación: Italia Pais de publicación: Suiza

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