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TITLE: The role of intermolecular interactions in [Fe(X-salEen)2]ClO4 spin crossover complexes  Full Text
AUTHORS: Bento, Marcos A.; Gomes, Tiago; Martins, Frederico F.; Gil, Adria; Ferreira, Liliana P.; Barroso, Sonia; Gomes, Clara S. B.; Garcia, Yann; Martinho, Paulo N.;
PUBLISHED: 2024, SOURCE: DALTON TRANSACTIONS, VOLUME: 53, ISSUE: 20
INDEXED IN: Scopus WOS CrossRef
IN MY: ORCID
2
TITLE: Influence of conventional hydrogen bonds in the intercalation of phenanthroline derivatives with DNA: The important role of the sugar and phosphate backbone  Full Text
AUTHORS: Sanchez Gonzalez, Angel; Grenut, Pierre; Gil, Adria;
PUBLISHED: 2022, SOURCE: JOURNAL OF COMPUTATIONAL CHEMISTRY, VOLUME: 43, ISSUE: 11
INDEXED IN: WOS
3
TITLE: Semi-empirical and linear-scaling DFT methods to characterize duplex DNA and G-quadruplexes in the presence of interacting small molecules
AUTHORS: Ortiz de Luzuriaga, Iker; Elleuchi, Sawssen; Jarraya, Khaled; Artacho, Emilio; Lopez, Xabier; Gil, Adria;
PUBLISHED: 2022, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 24, ISSUE: 19
INDEXED IN: Scopus WOS CrossRef: 8
IN MY: ORCID
4
TITLE: Computational Modelling of the Interactions Between Polyoxometalates and Biological Systems
AUTHORS: Gil, Adria; Carbo, Jorge J.;
PUBLISHED: 2022, SOURCE: FRONTIERS IN CHEMISTRY, VOLUME: 10
INDEXED IN: Scopus WOS
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TITLE: 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 ancillary ligands
AUTHORS: de Luzuriaga, Iker Ortiz; Sanchez Gonzalez, Angel; Synoradzki, Wojciech; Lopez, Xabier; Gil, Adria;
PUBLISHED: 2022, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 24, ISSUE: 42
INDEXED IN: Scopus WOS CrossRef: 5
IN MY: ORCID
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TITLE: Relationship between structure and cytotoxicity of vanadium and molybdenum complexes with pyridoxal derived ligands  Full Text
AUTHORS: Mato Lopez, Lucia; Sar Rano, Antia; Fernandez, Miguel Riopedre; Diaz Prado, Maria Luz; Gil, Adria; Sanchez Gonzalez, Angel; Fernandez Bertoez, Natalia; Mendez, Josefina; Valdiglesias, Vanessa; Avecilla, Fernando;
PUBLISHED: 2022, SOURCE: JOURNAL OF INORGANIC BIOCHEMISTRY, VOLUME: 235
INDEXED IN: WOS
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TITLE: Influence of conventional hydrogen bonds in the intercalation of phenanthroline derivatives with DNA: The important role of the sugar and phosphate backbone
AUTHORS: Ángel Sánchez‐González; Pierre Grenut; Adrià Gil;
PUBLISHED: 2022, SOURCE: Journal of Computational Chemistry, VOLUME: 43, ISSUE: 11
INDEXED IN: CrossRef: 7
IN MY: ORCID
8
TITLE: Photocatalytic degradation of acetaminophen and caffeine using magnetite-hematite combined nanoparticles: kinetics and mechanisms
AUTHORS: Fernandes, TA; Mendo, SG; Ferreira, LP; Neng, NUR; Oliveira, MC; Gil, A; Carvalho, MD; Monteiro, OC; Nogueira, JMF; Calhorda, MJ;
PUBLISHED: 2021, SOURCE: ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH, VOLUME: 28, ISSUE: 14
INDEXED IN: Scopus WOS CrossRef: 17
IN MY: ORCID
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