Reynier Suardíaz

Получаване на мой собствен потребителски профил

Позовавания

	Всички	От 2020
Позовавания	791	333
h-индекс	17	11
i10-индекс	28	11

20072008200920102011201220132014201520162017201820192020202120222023202420252 10 28 28 24 20 44 50 29 51 44 50 69 59 82 51 74 52 15

Публичен достъп

Преглед на всички

19 статии

5 статии

налични

неналични

Въз основа на изисквания при финансирането

Съавтори

Carlos S. PerezProfessor of Physical Chemistry, Havana UniversityПотвърден имейл адрес: fq.uh.cu
Rachel Crespo-OteroAssociate Professor at University College LondonПотвърден имейл адрес: qmul.ac.uk
Laura MasgrauUniversitat Autònoma de BarcelonaПотвърден имейл адрес: uab.cat
Edina RostaUniversity College LondonПотвърден имейл адрес: ucl.ac.uk
Adrian MulhollandProfessor of Chemistry, University of BristolПотвърден имейл адрес: bristol.ac.uk
Jesús San FabiánProfessor of Physical Chemistry, Universidad Autónoma de MadridПотвърден имейл адрес: uam.es
Pablo G. JambrinaInvestigador. Departamento de Química Física. Universidad de SalamancaПотвърден имейл адрес: usal.es
Marc van der KampAssociate Professor, University of BristolПотвърден имейл адрес: bris.ac.uk
Oren A. SchermanDirector of the Melville Laboratory for Polymer Synthesis, Department of Chemistry, University ofПотвърден имейл адрес: cam.ac.uk
Jesús del Barrio LasherasProfesor Contratado Doctor at Instituto de Nanociencia y Materiales de Aragón, INMAПотвърден имейл адрес: unizar.es
Luis Alberto Montero CabreraProfessor of Chemistry, Universidad de La HabanaПотвърден имейл адрес: fq.uh.cu
Philip HinchliffeUniversity of BristolПотвърден имейл адрес: bristol.ac.uk
Yihan ShaoUniversity of OklahomaПотвърден имейл адрес: ou.edu
Vijaykumar KaruppiahImmunocoreПотвърден имейл адрес: immunocore.com
Daniel G. RiveraFull Profesor, University of Havana & Guest Researcher Leibniz Instittute of Plant BiochemistryПотвърден имейл адрес: fq.uh.cu
JOSE A. GAVIN SAZATORNILProfesor Química Orgánica Universidad de La LagunaПотвърден имейл адрес: ull.edu.es
Simon L. DürrEPFLПотвърден имейл адрес: epfl.ch
Christine PeterProfessor of Computational Chemistry, University of KonstanzПотвърден имейл адрес: uni-konstanz.de
Eric J. M. LangUniversity of BristolПотвърден имейл адрес: bristol.ac.uk
Hanna KwonUniversity of LeicesterПотвърден имейл адрес: le.ac.uk

Следене

Reynier Suardíaz

Senior Research Fellow at the University of Portsmouth

Потвърден имейл адрес: port.ac.uk - Начална страница

Computational Chemistry Molecular Modeling Computational NMR QM/MM Enzyme Catalysis


Заглавие Сортиране по цитати Сортиране по година Сортиране по заглавие	Позовавания Позовавания	Година
A Dynamic and Responsive Host in Action: Light‐Controlled Molecular Encapsulation STJ Ryan, J Del Barrio, R Suardíaz, DF Ryan, E Rosta, OA Scherman Angewandte Chemie International Edition 55 (52), 16096-16100, 2016	62	2016
Structural characterization of arginine fingers: identification of an arginine finger for the pyrophosphatase dUTPases GN Nagy, R Suardíaz, A Lopata, O Ozohanics, K Vékey, BR Brooks, ... Journal of the American Chemical Society 138 (45), 15035-15045, 2016	49	2016
Biocatalytic routes to lactone monomers for polymer production HL Messiha, ST Ahmed, V Karuppiah, R Suardíaz, GA Ascue Avalos, ... Biochemistry 57 (13), 1997-2008, 2018	47	2018
Unraveling how enzymes can use bulky residues to drive site-selective C–H activation: The case of mammalian lipoxygenases catalyzing arachidonic acid oxidation P Saura, R Suardíaz, L Masgrau, JM Lluch, A González-Lafont ACS Catalysis 4 (12), 4351-4363, 2014	47	2014
Influence of density functionals and basis sets on one-bond carbon− carbon NMR spin− spin coupling constants R Suardíaz, C Pérez, R Crespo-Otero, JM García de la Vega, JS Fabián Journal of chemical theory and computation 4 (3), 448-456, 2008	44	2008
Understanding the mechanism of the hydrogen abstraction from arachidonic acid catalyzed by the human enzyme 15-lipoxygenase-2. A quantum mechanics/molecular mechanics free … R Suardiaz, PG Jambrina, L Masgrau, A Gonzalez-Lafont, E Rosta, ... Journal of chemical theory and computation 12 (4), 2079-2090, 2016	43	2016
Interactions between simple radicals and water R Crespo-Otero, E Sánchez-García, R Suardíaz, LA Montero, W Sander Chemical Physics 353 (1-3), 193-201, 2008	30	2008
Visualizing the protons in a metalloenzyme electron proton transfer pathway H Kwon, J Basran, JM Devos, R Suardíaz, MW Van der Kamp, ... Proceedings of the National Academy of Sciences 117 (12), 6484-6490, 2020	26	2020
Computational NMR coupling constants: Shifting and scaling factors for evaluating ¹J_CH J San Fabián, JM García De La Vega, R Suardíaz, M Fernández‐Oliva, ... Magnetic Resonance in Chemistry 51 (12), 775-787, 2013	26	2013
The role of conserved residues in the DEDDh motif: the proton-transfer mechanism of HIV-1 RNase H SL Dùrr, O Bohuszewicz, D Berta, R Suardiaz, PG Jambrina, C Peter, ... ACS Catalysis 11 (13), 7915-7927, 2021	24	2021
An insight into the regiospecificity of linoleic acid peroxidation catalyzed by mammalian 15-lipoxygenases R Suardíaz, L Masgrau, JM Lluch, A Gonzalez-Lafont The Journal of Physical Chemistry B 117 (14), 3747-3754, 2013	24	2013
On the unusual ²J coupling dependence on *syn/anti* CHO conformation in 5‐X‐furan‐2‐carboxaldehydes C Pérez, R Suardíaz, PJ Ortiz, R Crespo‐Otero, GM Bonetto, JA Gavín, ... Magnetic Resonance in Chemistry 46 (9), 846-850, 2008	24	2008
Catalytic mechanism of the colistin resistance protein MCR-1 R Suardíaz, E Lythell, P Hinchliffe, M van der Kamp, J Spencer, N Fey, ... Organic & biomolecular chemistry 19 (17), 3813-3819, 2021	23	2021
Theoretical Karplus relationships for vicinal coupling constants around χ1 in Valine R Suardíaz, C Pérez, JMG de la Vega, J San Fabián, RH Contreras Chemical physics letters 442 (1-3), 119-123, 2007	23	2007
Understanding the molecular mechanism of the Ala-versus-Gly concept controlling the product specificity in reactions catalyzed by lipoxygenases: a combined molecular dynamics … P Saura, R Suardíaz, L Masgrau, A González-Lafont, E Rosta, JM Lluch ACS catalysis 7 (7), 4854-4866, 2017	20	2017
Approximating correlation effects in multiconfigurational self-consistent field calculations of spin-spin coupling constants J San Fabián, E Díez, JM García De La Vega, R Suardíaz The Journal of chemical physics 128 (8), 2008	20	2008
NMR spin–spin coupling constants and hyperconjugative interactions RH Contreras, R Suardíaz, C Pérez, R Crespo‐Otero, J San Fabián, ... International Journal of Quantum Chemistry 110 (3), 532-539, 2010	18	2010
Regio‐and Stereospecificity in the Oxygenation of Arachidonic Acid Catalyzed by Leu597 Mutants of Rabbit 15‐Lipoxygenase: A QM/MM Study R Suardíaz, L Masgrau, JM Lluch, À González‐Lafont ChemPhysChem 15 (11), 2303–2310, 2014	17	2014
On the Regio‐and Stereospecificity of Arachidonic Acid Peroxidation Catalyzed by Mammalian 15‐Lypoxygenases: A Combined Molecular Dynamics and QM/MM Study R Suardíaz, L Masgrau, JM Lluch, À González‐Lafont ChemPhysChem 14 (16), 3777-3787, 2013	17	2013
Steric and Electronic Situation in the 4-X-4′-[(4′′-Y-Phenyl) ethynyl] biphenyl Homologous Series: A Joint Theoretical and Spectroscopic Study PD Ortiz, R Suardiaz, L De Vega, G Hennrich, PJ Ortiz The Journal of Physical Chemistry A 114 (8), 2939-2944, 2010	16	2010

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