Research output per year
Research output per year
Personal profile
Research interests
Current research interests include the use of theoretical methods (QM/MM, Free Energy Calculations, Molecular Dynamics, Quantum Chemistry and others) to study the reaction mechanisms and specificity of enzymes. Current projects involve various phosphate processing enzymes (topoisomerases, dUTPase, D-Alanine ligase) and lipoxygenases. Reynier research also includes the calculation of NMR parameters to assist experiments and to find new relationships between them and structural features of biomolecules.
Education/Academic qualification
Physical Chemistry, Doctor of Science, Universidad Autónoma de Madrid
External positions
Research Associate , Universitat Autònoma de Barcelona
1 Jul 2014 → 30 Oct 2014
Visiting Research Fellow, King's College London
1 Apr 2014 → 29 Jun 2014
Research Fellow, Universitat Autònoma de Barcelona
2011 → 2013
Postdoctoral Fellow, University of Cambridge
2010 → 2011
Assistant Professor, University of Havana
2009 → 2010
Fingerprint
Dive into the research topics where Reynier Suardíaz is active. These topic labels come from the works of this person. Together they form a unique fingerprint.
- 1 Similar Profiles
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QM/MM Simulations Show Saccharide Distortion is Required for Reaction in Hen Egg-White Lysozyme
Limb, M., Suardiaz, R., Grant, I. & Mulholland, A., 22 Oct 2018, (E-pub ahead of print) In: Chemistry - A European Journal.Research output: Contribution to journal › Article › peer-review
Open AccessFile5 Citations (Scopus)232 Downloads (Pure) -
Understanding the Molecular Mechanism of the Ala-versus-Gly Concept Controlling the Product Specificity in Reactions Catalyzed by Lipoxygenases: A Combined Molecular Dynamics and QM/MM Study of Coral 8R-Lipoxygenase
Saura, P., Suardíaz, R., Masgrau, L., González-Lafont, À., Rosta, E. & Lluch, J. M., 9 May 2017, In: ACS Catalysis. 7, 7, p. 4854-4866 13 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile17 Citations (Scopus)206 Downloads (Pure) -
A Dynamic and Responsive Host in Action: Light-Controlled Molecular Encapsulation
Ryan, S. T. J., Del Barrio, J., Suardiaz, R., Ryan, D. F., Rosta, E. & Scherman, O. A., 28 Oct 2016, In: ANGEWANDTE CHEMIE-INTERNATIONAL EDITION.Research output: Contribution to journal › Article › peer-review
Open AccessFile57 Citations (Scopus)165 Downloads (Pure) -
Structural Characterization of Arginine Fingers: Identification of an Arginine Finger for the Pyrophosphatase dUTPases
Nagy, G. N., Suardiaz, R., Lopata, A., Ozohanics, O., Vékey, K., Brooks, B. R., Leveles, I., Toth, J., Vértessy, B. G. & Rosta, E., 16 Nov 2016, In: Journal of the American Chemical Society. 138, 45, p. 15035-15045 11 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile30 Citations (Scopus)267 Downloads (Pure) -
Understanding the Mechanism of the Hydrogen Abstraction from Arachidonic Acid Catalyzed by the Human Enzyme 15-Lipoxygenase-2. A Quantum Mechanics/Molecular Mechanics Free Energy Simulation
Suardíaz, R., Jambrina, P. G., Masgrau, L., González-Lafont, À., Rosta, E. & Lluch, J. M., 9 Mar 2016, In: Journal of Chemical Theory and Computation. 12, 4, p. 2079-2090 11 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile34 Citations (Scopus)421 Downloads (Pure)
Datasets
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A Dynamic and Responsive Host in Action: Light-Controlled Molecular Encapsulation - Part 2
Ryan, S. T. J., Del Barrio, J., Ryan, D. F., Scherman, O. A., Suardíaz, R. & Rosta, E., King's College London, 2 Mar 2022
DOI: 10.18742/16553784.v1, https://kcl.figshare.com/articles/dataset/A_Dynamic_and_Responsive_Host_in_Action_Light-Controlled_Molecular_Encapsulation_-_Part_2/16553784/1
Dataset
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Structural Characterization of Arginine Fingers - Identification of an Arginine Finger for the Pyrophosphatase dUTPases - Part 2
Suardíaz, R., Rosta, E., Nagy, G., Lopata, A., Ozohanics, O., Vékey, K., Brooks, B. R., Leveles, I., Tóth, J. & Vértessy, B. G., King's College London, 2 Mar 2022
DOI: 10.18742/16558074, https://kcl.figshare.com/articles/dataset/Structural_Characterization_of_Arginine_Fingers_-_Identification_of_an_Arginine_Finger_for_the_Pyrophosphatase_dUTPases_-_Part_2/16558074/1
Dataset
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A Dynamic and Responsive Host in Action Light-Controlled Molecular Encapsulation
Ryan, S. T. J., Del Barrio, J., Ryan, D. F., Scherman, O. A., Suardíaz, R. & Rosta, E., King's College London, 28 Sept 2016
DOI: 10.18742/rdm01-51, https://kcl.figshare.com/articles/dataset/A_Dynamic_and_Responsive_Host_in_Action_Light-Controlled_Molecular_Encapsulation/16473651
Dataset
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Structural Characterization of Arginine Fingers - Identification of an Arginine Finger for the Pyrophosphatase dUTPases
Suardíaz, R., Rosta, E., Nagy, G. N., Lopata, A., Ozohanics, O., Vékey, K., Brooks, B. R., Leveles, I., Toth, J. & Vértessy, B. G., King's College London, 31 Oct 2016
DOI: 10.18742/rdm01-77, https://kcl.figshare.com/articles/dataset/Structural_Characterization_of_Arginine_Fingers_-_Identification_of_an_Arginine_Finger_for_the_Pyrophosphatase_dUTPases/16473666
Dataset
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Files associated with free energy calculations of 1st and 2nd step of the reaction mechanism
Suardíaz, R., Rosta, E., Saura, P., Masgrau, L., González-Lafont, À. & Lluch, J. M., King's College London, 21 Jun 2017
DOI: 10.18742/rdm01-204, https://kcl.figshare.com/articles/dataset/Files_associated_with_free_energy_calculations_of_1st_and_2nd_step_of_the_reaction_mechanism/16473714
Dataset