Listado de producción
| Titulo | Año | Tipo |
|---|---|---|
Aggregation of nucleobases and metabolites: Adenine-theobromine trimersThe Journal of Chemical Physics 158 (6), 064304, 2023
A Camiruaga, I Usabiaga, P Pinillos, FJ Basterretxea, JA Fernández, ...
|
2023 | Artículo |
Accelerating Reaction Rates of Biomolecules by Using Shear Stress in Artificial Capillary SystemsJournal of the American Chemical Society, 2021
TA Hakala, EV Yates, PK Challa, Z Toprakcioglu, K Nadendla, ...
|
2021 | Artículo |
Exploring Epigenetic Marks by Analysis of Noncovalent InteractionsChemBioChem, 2020
J Millán, A Lesarri, JA Fernández, R Martínez
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2020 | Artículo |
Isomerism of the Aniline TrimerAngewandte Chemie 130 (46), 15332-15336, 2018
C Pérez, I León, A Lesarri, BH Pate, R Martínez, J Millán, JA Fernández
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2018 | Artículo |
Competition between stacked and hydrogen bonded structures of cytosine aggregatesPhysical Chemistry Chemical Physics 19 (13), 8826-8834, 2017
J González, I Usabiaga, PF Arnaiz, I León, R Martínez, J Millán, ...
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2017 | Artículo |
Conformational landscape of isolated capped amino acids: on the nature of non-covalent interactionsThe European Physical Journal D 71 (8), 203, 2017
J González, R Martínez, JA Fernández, J Millan
|
2017 | Artículo |
Dynamics of the O + H2+ → OH+ + H, OH + H+ proton and hydrogen atom transfer reactions on the two lowest potential energy surfacesPhys. Chem. Chem. Phys. 19, 3857-3868, 2017
MG Rodrigo Martínez, Miguel Paniagua, Jordi Mayneris-Perxachs, Pablo Gamallo
|
2017 | Artículo |
Theoretical Study of the Free Energy Surface and Kinetics of the Hepatitis C Virus NS3/NS4A Serine Protease Reaction with the NS5A/5B Substrate. Does the Generally Accepted …ACS Catalysis 5 (1), 246-255, 2015
JÁ Martínez-González, M González, L Masgrau, R Martínez
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2015 | Artículo |
Exploring the stereodynamics and microscopic mechanism of the O (3P)+ CH4, CD4→ OH+ CH3, OD+ CD3 combustion reactionsChemical Physics 461, 98-105, 2015
R Martínez, PA Enríquez, MP Puyuelo, M González
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2015 | Artículo |
Further theoretical insight into the reaction mechanism of the hepatitis C NS3/NS4A serine proteaseChemical Physics Letters 619, 97-102, 2015
JÁ Martínez-González, A Rodríguez, MP Puyuelo, M González, ...
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2015 | Artículo |
Potential energy surfaces and quasiclassical trajectory study of the O+ H 2+→ OH++ H, OH+ H+ proton and hydrogen atom transfer reactions and isotopic variants (D 2+, HD+)Physical Chemistry Chemical Physics 16 (43), 23594-23603, 2014
M Paniagua, R Martínez, P Gamallo, M González
|
2014 | Artículo |
Understanding the effect of vibrational excitation in reaction dynamics: the Ne+ H 2+(v= 0–17, j= 1)→ NeH++ H, Ne+ H++ H proton transfer and dissociation cross sectionsPhysical Chemistry Chemical Physics 16 (14), 6641-6648, 2014
P Gamallo, R Martínez, JD Sierra, M González
|
2014 | Artículo |
Experimentando con las redes sociales en la enseñanza universitaria en cienciasUniversidad de Cádiz/Asociación de Profesores Amigos de la Ciencia Eureka, 2013
R Martínez, F Corzana, J Millán
|
2013 | Artículo |
QM/MM study of HCV NS3/NS4A protease with its main substrates: from the structure to the kineticsEUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS 42, S196-S196, 2013
JA Martinez, R Martinez, MP Puyuelo, L Masgrau, M Gonzalez
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2013 | Artículo |
Dynamics of the O (3P)+ CH4→ OH+ CH3 Reaction is Similar to That of a Triatomic ReactionThe Journal of Physical Chemistry A 116 (21), 5026-5029, 2012
R Martínez, PA Enríquez, MP Puyuelo, M González
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2012 | Artículo |
Theoretical Study of the Dynamics and Kinetics of the O+ CS→ CO+ S Chemical Laser Reaction, Where CO Shows a Very High Vibrational ExcitationThe Journal of Physical Chemistry A 116 (48), 11783-11795, 2012
P Gamallo, R Francia, R Martínez, R Sayós, M González
|
2012 | Artículo |
Dynamics of the O(3P) + CH4 → OH + CH3 Reaction Is Similar To That of a Triatomic ReactionThe Journal of Physical Chemistry A 116 (21), 5026-5029, 2012
R Martínez, PA Enríquez, MP Puyuelo, M González
|
2012 | Artículo |
Quasiclassical dynamics and kinetics of the , atmospheric reactionsThe Journal of chemical physics 132 (14), 144304, 2010
P Gamallo, R Martínez, R Sayós, M González
|
2010 | Artículo |
The OH+ D 2→ HOD+ D angle–velocity distribution: quasi-classical trajectory calculations on the YZCL2 and WSLFH potential energy surfaces and comparison with experiments at ET …Physical Chemistry Chemical Physics 11 (48), 11520-11527, 2009
JD Sierra, R Martínez, J Hernando, M González
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2009 | Artículo |
Quantum dynamics study of the reaction and comparison with quasiclassical trajectory resultsThe Journal of chemical physics 128 (14), 144302, 2008
J Mayneris, R Martínez, J Hernando, SK Gray, M González
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2008 | Artículo |
Searching for resonances in the reaction : Quantum versus quasiclassical dynamics and comparison with experimentsThe Journal of chemical physics 127 (10), 104302, 2007
R Martínez, M González, P Defazio, C Petrongolo
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2007 | Artículo |
Time dependent quantum dynamics study of the ion-molecule reaction and isotopic variantsThe Journal of Chemical Physics 125 (16), 164305, 2006
R Martínez, JD Sierra, SK Gray, M González
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2006 | Artículo |
Exact quantum dynamics study of the ion-molecule reaction and comparison with quasiclassical trajectory calculationsThe Journal of chemical physics 124 (14), 144301, 2006
R Martínez, JM Lucas, X Giménez, A Aguilar, M González
|
2006 | Artículo |
Cross sections of the ion-molecule reaction and isotopic variants (, HD): Quasiclassical trajectory study and comparison with experimentsThe Journal of chemical physics 123 (17), 174312, 2005
R Martínez, JD Sierra, M González
|
2005 | Artículo |
Ab initio analytical potential energy surface and quasiclassical trajectory study of the O (+)((4) S)+ H (2)(X (1) Sigma (g)(+))–> OH (+)(X (3) Sigma (-))+ H ((2) S) reaction …The Journal of chemical physics 120 (10), 4705-4714, 2004
R Martínez, J Millán, M Gonzalez
|
2004 | Artículo |
Nascent OH (X2Π) product state distributions from the reaction of O (1D) with ethylene.: A laser-induced fluorescence studyChemical physics letters 346 (1-2), 69-80, 2001
M González, MP Puyuelo, J Hernando, R Martı́nez, R Sayós, PA Enrı́quez
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2001 | Artículo |