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Adria Gil-Mestres
Adria Gil-Mestres
Senior Investigator
Verified email at csic.es - Homepage
Title
Cited by
Cited by
Year
Trends in the adsorption of 3d transition metal atoms onto graphene and nanotube surfaces: a DFT study and molecular orbital analysis
H Valencia, A Gil, G Frapper
The Journal of Physical Chemistry C 114 (33), 14141-14153, 2010
2292010
On the origin of the cation templated self-assembly of uranyl-peroxide nanoclusters
P Miro, S Pierrefixe, M Gicquel, A Gil, C Bo
Journal of the American Chemical Society 132 (50), 17787-17794, 2010
1192010
Modulation of lipid‐induced ER stress by fatty acid shape
J Deguil, L Pineau, EC Rowland Snyder, S Dupont, L Beney, A Gil, ...
Traffic 12 (3), 349-362, 2011
1022011
Catalysis in a porous molecular capsule: Activation by regulated access to sixty metal centers spanning a truncated icosahedron
S Kopilevich, A Gil, M Garcia-Ratés, J Bonet-Ávalos, C Bo, A Müller, ...
Journal of the American Chemical Society 134 (31), 13082-13088, 2012
892012
Structure and fragmentation of glycine, alanine, serine and cysteine radical cations. A theoretical study
S Simon, A Gil, M Sodupe, J Bertrán
Journal of Molecular Structure: THEOCHEM 727 (1-3), 191-197, 2005
872005
Trends in the hydrogen activation and storage by adsorbed 3d transition metal atoms onto graphene and nanotube surfaces: A DFT study and molecular orbital analysis
H Valencia, A Gil, G Frapper
The Journal of Physical Chemistry C 119 (10), 5506-5522, 2015
692015
Base‐Catalyzed Anti‐Markovnikov Hydroamination of Vinylarenes–Scope, Limitations and Computational Studies
P Horrillo‐Martínez, KC Hultzsch, A Gil, V Branchadell
European journal of organic chemistry 2007 (20), 3311-3325, 2007
642007
CH/π interactions in DNA and proteins. A theoretical study
A Gil, V Branchadell, J Bertran, A Oliva
The Journal of Physical Chemistry B 111 (31), 9372-9379, 2007
622007
Influence of the side chain in the structure and fragmentation of amino acids radical cations
A Gil, S Simon, L Rodríguez-Santiago, J Bertrán, M Sodupe
Journal of Chemical Theory and Computation 3 (6), 2210-2220, 2007
582007
An analysis of the different behavior of DNA and RNA through the study of the mutual relationship between stacking and hydrogen bonding
A Gil, V Branchadell, J Bertran, A Oliva
The Journal of Physical Chemistry B 113 (14), 4907-4914, 2009
522009
A Journey inside the U28 Nanocapsule
A Gil, D Karhánek, P Miró, MR Antonio, M Nyman, C Bo
Chemistry–A European Journal 18 (27), 8340-8346, 2012
492012
A model of tetrahydrofuran low-temperature oxidation based on theoretically calculated rate constants
Y Fenard, A Gil, G Vanhove, HH Carstensen, KM Van Geem, ...
Combustion and Flame 191, 252-269, 2018
462018
Self‐Assembly of Uranyl–Peroxide Nanocapsules in Basic Peroxidic Environments
P Miró, B Vlaisavljevich, A Gil, PC Burns, M Nyman, C Bo
Chemistry–A European Journal 22 (25), 8571-8578, 2016
382016
How the intercalation of phenanthroline affects the structure, energetics, and bond properties of DNA base pairs: theoretical study applied to adenine–thymine and guanine …
A Gil, M Melle-Franco, V Branchadell, MJ Calhorda
Journal of chemical theory and computation 11 (6), 2714-2728, 2015
312015
Electrochemical studies and potential anticancer activity in ferrocene derivatives
S Realista, S Quintal, PN Martinho, AI Melato, A Gil, T Esteves, ...
Journal of Coordination Chemistry 70 (2), 314-327, 2017
302017
Effects of ionization on N-glycylglycine peptide: Influence of intramolecular hydrogen bonds
A Gil, J Bertran, M Sodupe
The Journal of chemical physics 124 (15), 2006
272006
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
252021
The Energy Landscape of Uranyl–Peroxide Species
E Tiferet, A Gil, C Bo, TY Shvareva, M Nyman, A Navrotsky
Chemistry–A European Journal 20 (13), 3646-3651, 2014
252014
Learning to model G-quadruplexes: current methods and perspectives
I Ortiz de Luzuriaga, X Lopez, A Gil
Annual Review of Biophysics 50, 209-243, 2021
242021
A theoretical study of methylation and CH/π interactions in DNA intercalation: methylated 1, 10-phenanthroline in adenine–thymine base pairs
A Gil, V Branchadell, MJ Calhorda
RSC advances 6 (89), 85891-85902, 2016
232016
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Articles 1–20