Mostrando 3 resultados de: 3
Filtros aplicados
Subtipo de publicación
Article(3)
Área temáticas
Farmacología y terapéutica(1)
Métodos informáticos especiales(1)
Química física(1)
Química orgánica(1)
Área de conocimiento
Ciencia de materiales(1)
Descubrimiento de fármacos(1)
Farmacología(1)
Mecánica cuántica(1)
Relación cuantitativa estructura-actividad(1)
Origen
scopus(3)
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:scopusFacet diagrams for quantum similarity data
ArticleAbstract: The objective of this work is to demonstrate that an appropriate treatment of quantum similarity matPalabras claves:Atomic Shell Approximation (ASA) density functions, Carbó index, Classical scaling, Cramer steroids, Facet theory, Quantitative structure-activity relationships (QSAR), Quantum Similarity, ToxicityAutores:Gironés X., Ramón Carbö-D̈orca, Robert D.Fuentes:scopusModelling toxicity using molecular quantum similarity measures
ArticleAbstract: In this work, a general procedure for the application of Molecular Quantum Similarity Measures (MQSMPalabras claves:Aquatic toxicity, PLS, QSTR, Quantum Similarity, TGSAAutores:Gironés X., Ramón Carbö-D̈orcaFuentes:scopus