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Subtipo de publicación
Article(2)
Publisher
International Journal of Quantum Chemistry(1)
Journal of Chemical Information and Computer Sciences(1)
Área de conocimiento
Biología molecular(1)
Ciencia de materiales(1)
Relación cuantitativa estructura-actividad(1)
Objetivos de Desarrollo Sostenible
ODS 12: Producción y consumo responsables(2)
ODS 3: Salud y bienestar(2)
ODS 9: Industria, innovación e infraestructura(2)
Año de Publicación
2000(2)
Origen
scopus(2)
Quantification of the Influence of Single-Point Mutations on Haloalkane Dehalogenase Activity: A Molecular Quantum Similarity Study
ArticleAbstract: Controlled modifications in certain protein amino acid residues can lead to changes in their functioPalabras claves:Autores:Gironés X., Ramón Carbö-D̈orca, Robert D.Fuentes:scopusQuantum similarity QSAR: Study of inhibitors binding to thrombin, trypsin, and factor Xa, including a comparison with CoMFA and CoMSIA methods
ArticleAbstract: Descriptors derived from molecular quantum similarity (MQS) theory were used to construct three-dimePalabras claves:Autores:Amat L., Ramón Carbö-D̈orca, Robert D.Fuentes:scopus