A molecular dynamics approach to ligand-receptor interaction in the aspirin-human serum albumin complex

In this work, we present a study of the interaction between human serum albumin (HSA) and acetylsalicylic acid (ASA, C9H8O 4) by molecular dynamics simulations (MD). Starting from an experimentally resolved structure of the complex, we performed the extraction of the ligand by means of the applicati...

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Autores principales: Álvarez, Hugo Ariel, McCarthy, Andrés Norman, Grigera, José Raúl
Formato: Articulo
Lenguaje:Inglés
Publicado: 2012
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Acceso en línea:http://sedici.unlp.edu.ar/handle/10915/83618
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