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New insights on the interaction of phenanthroline based ligands and metal complexes and polyoxometalates with duplex dna and g-quadruplexes
ReviewAbstract: This work provides new insights from our team regarding advances in targeting canonical and non-canoPalabras claves:Artificial phosphoesterases, DNA, G-quadruplexes, intercalation, LS-DFT, Mo-oxo species, phenanthroline derivatives, Phosphoester hydrolysis catalysis, Polyoxometalates, Weak interactionsAutores:Ángel Sánchez-González, Bandeira N.A.G., Calhorda M.J., de Luzuriaga I.O., Elleuchi S., Gil A., Jarraya K., Lanuza J., Lopez X., Martins F.F.Fuentes:scopusUnravelling the binding affinity and selectivity of molybdenum(ii) phenanthroline complexes with DNA G-quadruplexes by using linear-scaling DFT studies. The important role of ancillary ligands
ArticleAbstract: We have used near linear-scaling density functional theory (LS-DFT) methods including dispersion, foPalabras claves:Autores:Ángel Sánchez-González, Gil A., Lopez X., Ortiz De Luzuriaga I., Synoradzki W.Fuentes:scopusRelationship between structure and cytotoxicity of vanadium and molybdenum complexes with pyridoxal derived ligands
ArticleAbstract: In this work four vanadium complexes (compounds 1, 2, 3 and 4) and one molybdenum complex (compoundPalabras claves:A549 cell line, Cytotoxicity, Intercalator, stability, Vanadium, Zebrafish modelAutores:Ángel Sánchez-González, Avecilla F., Díaz-Prado M.L., Fernández M.R., Fernández-Bertólez N., Gil A., Mato-López L., Méndez J., Sar-Rañó A., Valdiglesias V.Fuentes:scopusProbing the Catalytically Active Species in POM-Catalysed DNA-Model Hydrolysis**
ArticleAbstract: Phosphoester hydrolysis is an important chemical step in DNA repair. One archetypal molecular modelPalabras claves:artificial phophoesterases, DFT, DNA, phosphoester hydrolysis, polyoxometalateAutores:Ángel Sánchez-González, Bandeira N.A.G., Gil A., Lanuza J., Lopez X., Martins F.F., Miras H.N.Fuentes:scopus