Mostrando 4 resultados de: 4
Filtros aplicados
Subtipo de publicación
Article(4)
Publisher
International Journal of Pharmaceutics(1)
Journal of Computer-Aided Molecular Design(1)
Match(1)
Phytochemistry(1)
Área temáticas
Química analítica(2)
Ecología(1)
Ingeniería química(1)
Química física(1)
Química inorgánica(1)
Área de conocimiento
Farmacología(2)
Relación cuantitativa estructura-actividad(2)
Descubrimiento de fármacos(1)
Fitopatología(1)
Planta(1)
Origen
scopus(4)
Antimalarial activity of synthetic 1,2,4-trioxanes and cyclic peroxy ketals, a quantum similarity study
ArticleAbstract: In this work, the antimalarial activity of two series of 20 and 7 synthetic 1,2,4-trioxanes and a sePalabras claves:1,2,4-trioxanes, Artemisinin, MALARIA, MQSM, Peroxy ketals, Plasmodium falciparum, QSAR, Quantum SimilarityAutores:Gallegos A., Gironés X., Ramón Carbö-D̈orcaFuentes:scopusUnrevealed structural requirements for auxin-like molecules by theoretical and experimental evidences
ArticleAbstract: An computational-biostatistical approach, supported by ab initio optimizations of auxin-like moleculPalabras claves:auxin, Molecular quantum similarity measures, Plant growth regulation, Structure-activity relationshipAutores:Bultinck P., Ferro N., Gallegos A., Jacobsen H.J., Ramón Carbö-D̈orca, Reinard T.Fuentes:scopusSimilarity approach to QSAR: Application to antimycobacterial benzoxazines
ArticleAbstract: The antimycobacterial activity in six series of substituted 3-phenyl-2H-benzoxazine-2,4(3H)-dithionePalabras claves:Benzoxazine, Mycobacterium, Quantum molecular similarity, Theoretical QSAR models, TuberculostaticsAutores:Gallegos A., Ponec R., Ramón Carbö-D̈orca, Waisser K.Fuentes:scopusTopological quantum similarity indices and their use in QSAR: Application to several families of antimalarial compounds
ArticleAbstract: New 3D molecular topological indices are described. From the underlying theoretical foundation, it iPalabras claves:Autores:Besalu E., Gallegos A., Ramón Carbö-D̈orcaFuentes:scopus