New insights on the interaction of phenanthroline based ligands and metal complexes and polyoxometalates with duplex DNA and G-quadruplexes Á Sánchez-González, NAG Bandeira, I Ortiz de Luzuriaga, FF Martins, ... Molecules 26 (16), 4737, 2021 | 28 | 2021 |
Learning to model G-quadruplexes: current methods and perspectives I Ortiz de Luzuriaga, X Lopez, A Gil Annual Review of Biophysics 50 (1), 209-243, 2021 | 28 | 2021 |
Computational Studies on the Binding Preferences of Molybdenum (II) Phenanthroline Complexes with Duplex DNA. The Important Role of the Ancillary Ligands S Elleuchi, I Ortiz de Luzuriaga, A Sanchez-Gonzalez, X Lopez, K Jarraya, ... Inorganic Chemistry 59 (17), 12711-12721, 2020 | 17 | 2020 |
Semi-empirical and linear-scaling DFT methods to characterize duplex DNA and G-quadruplexes in the presence of interacting small molecules IO de Luzuriaga, S Elleuchi, K Jarraya, E Artacho, X López, A Gil Physical Chemistry Chemical Physics, 2022 | 11 | 2022 |
Unravelling the binding affinity and selectivity of molybdenum (II) phenanthroline complexes with DNA G-quadruplexes by using linear-scaling DFT studies. The important role of … IO de Luzuriaga, Á Sánchez-González, W Synoradzki, X Lopez, A Gil Physical Chemistry Chemical Physics 24 (42), 25918-25929, 2022 | 5 | 2022 |
Role of Dispersion Interactions in Endohedral TM@(ZnS)12 Structures E Jimenez-Izal, I Ortiz de Luzuriaga, E Ramos-Cordoba, JM Matxain ACS omega 6 (25), 16612-16622, 2021 | | 2021 |