Coarse-Grained Models for Constant pH Simulations of Carboxylic Acids.

Islam, Naeyma N; Sharma, Arjun; Gyawali, Gaurav; Kumar, Revati; Rick, Steven W

Islam, Naeyma N; Sharma, Arjun; Gyawali, Gaurav; Kumar, Revati; Rick, Steven W.

Afiliación

Islam NN; Department of Chemistry , University of New Orleans , New Orleans , Louisiana 70148 , United States.
Sharma A; Department of Chemistry , University of New Orleans , New Orleans , Louisiana 70148 , United States.
Gyawali G; Department of Chemistry , University of New Orleans , New Orleans , Louisiana 70148 , United States.
Kumar R; Department of Chemistry , Louisiana State University , Baton Rouge , Louisiana 70808 , United States.
Rick SW; Department of Chemistry , University of New Orleans , New Orleans , Louisiana 70148 , United States.

J Chem Theory Comput ; 15(8): 4623-4631, 2019 Aug 13.

Article en En | MEDLINE | ID: mdl-31265273

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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: J Chem Theory Comput Año: 2019 Tipo del documento: Article País de afiliación: Estados Unidos Pais de publicación: Estados Unidos

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