Sam Hay

educated at: Australian National University, University of Otago

Sam Hay is a chemist from New Zealand and a Reader in the Department of Chemistry at The University of Manchester. His research in general is based on computational chemistry and theoretical chemistry, specifically on the areas of In silico Enzymology, quantum mechanics roles in biological processes, kinetic modelling of complex reactions and high pressure spectroscopy. Source: Wikipedia (en)

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Articles 94

Date

Title

Authors

2022-03-23

Chelator-Based Parameterization of the 12-6-4 Lennard-Jones Molecular Mechanics Potential for More Realistic Metal Ion–Protein Interactions

Sam Hay
2020-07-27

Enzymatic C-H activation of aromatic compounds through CO2 fixation

Annica Saaret, Irina Gostimskaya, Sam Hay, David Leys
2019-09-11

MhuD from Mycobacterium tuberculosis: Probing a Dual Role in Heme Storage and Degradation

Sam Hay, Perdita Barran, Andrew Munro
2019-05-03

Equatorial Active Site Compaction and Electrostatic Reorganization in Catechol--methyltransferase

Sylwia Czarnota, Colin W Levy, Nigel Scrutton, Sam Hay, Jonathan Waltho
2019-05-23

Photochemical Spin Dynamics of the Vitamin B12 Derivative, Methylcobalamin

Derren J Heyes, Nigel Scrutton, Sam Hay, Alistair J. Fielding, Alex R. Jones
2019-05-16

Evaluating spectral overlap with the degree of quenching in UCP luminescence energy transfer systems

Alex R. Jones, Sam Hay
2019-05-29

Unexpected Roles of a Tether Harboring a Tyrosine Gatekeeper Residue in Modular Nitrite Reductase Catalysis

Derren J Heyes, Gareth S A Wright, Sam Hay, Nigel Scrutton
2019-09-01

Graphene-aramid nanocomposite fibres via superacid co-processing

Aled D Roberts, Robert T Woodward, Matthieu Gresil, Christopher F. Blanford, Sam Hay, Jonny J. Blaker, Nigel Scrutton
2019-09-16

Enzymatic control of cycloadduct conformation ensures reversible 1,3-dipolar cycloaddition in a prFMN-dependent decarboxylase

Karl A P Payne, Annica Saaret, Stephen A Marshall, Karl Fisher, Sam Hay, David Leys
2019-12-01

What are the signatures of tunnelling in enzyme-catalysed reactions?

Nigel Scrutton, Sam Hay
2019-12-01

Zero-point energy and tunnelling: general discussion

Scott Habershon, Sam Hay, Ksenia G. Komarova, Reinhard J Maurer, David P Tew
2018-04-03

Pressurized CO2 as a carboxylating agent for the biocatalytic ortho-carboxylation of resorcinol.

Walter Keller, Sam Hay, Derren J Heyes, Silvia M Glueck, Gerhard Hofer
2018-10-26

Nonequivalence of Second Sphere "Noncatalytic" Residues in Pentaerythritol Tetranitrate Reductase in Relation to Local Dynamics Linked to H-Transfer in Reactions with NADH and NADPH Coenzymes

Sam Hay, Nigel Scrutton, Andreea I Iorgu, Colin W Levy, Jonathan Waltho
2017-09-08

Decoupled Associative and Dissociative Processes in Strong yet Highly Dynamic Host-Guest Complexes

Sam Hay, Eric A Appel, Oren A Scherman, Frank Biedermann
2017-02-13

A common mechanism for coenzyme cobalamin-dependent reductive dehalogenases.

Sam Hay
2017-09-13

Expanding the Scope of Biomolecule Monitoring with Ratiometric Signaling from Rare-Earth Upconverting Phosphors

Peter Harvey, Alex R. Jones, Sam Hay
2017-04-03

Convergence of theory and experiment on the role of preorganization, quantum tunneling and enzyme motions into flavoenzyme-catalyzed hydride transfer

Sam Hay, Vicent Moliner, Iñaki Tuñón, Nigel Scrutton
2016-06-28

Correlating Calmodulin Landscapes with Chemical Catalysis in Neuronal Nitric Oxide Synthase using Time-Resolved FRET and a 5-Deazaflavin Thermodynamic Trap

Nicole G H Leferink, Sam Hay, Nigel Scrutton
2016-09-09

Time Course Analysis of Enzyme-Catalyzed DNA Polymerization

Sam Hay
2016-11-16

An oxidative N-demethylase reveals PAS transition from ubiquitous sensor to enzyme

Binuraj R K Menon, Tewes Tralau, Andrew Munro, Sam Hay, Nigel Scrutton
2016-12-15

1H, 15N, 13C backbone resonance assignments of human soluble catechol O-methyltransferase in complex with S-adenosyl-L-methionine and 3,5-dinitrocatechol

Sam Hay, Sylwia Czarnota, Jonathan Waltho, Nigel Scrutton
2016-09-09

A perspective on conformational control of electron transfer in nitric oxide synthases

Sam Hay, Nigel Scrutton, Tobias M Hedison
2016-10-07

Untangling Heavy Protein and Cofactor Isotope Effects on Enzyme-Catalyzed Hydride Transfer

Samantha J O Hardman, Sam Hay, Nigel Scrutton
2016-08-24

Donor-Acceptor Distance Sampling Enhances the Performance of "Better than Nature" Nicotinamide Coenzyme Biomimetics.

Sam Hay, Caroline E. Paul, Nigel Scrutton
2016-09-12

Ground-State Destabilization by Phe-448 and Phe-449 Contributes to Tyrosine Phenol-Lyase Catalysis

Sam Hay
2015-06-17

UbiX is a flavin prenyltransferase required for bacterial ubiquinone biosynthesis

Mark D White, Karl A P Payne, Stephen A Marshall, Nicholas J W Rattray, Drupad K Trivedi, Roy Goodacre, Sam Hay, Nigel Scrutton
2015-08-01

Does the pressure dependence of kinetic isotope effects report usefully on dynamics in enzyme H-transfer reactions?

Nigel Scrutton, Sam Hay, Derren J Heyes
2015-08-26

Real-time analysis of conformational control in electron transfer reactions of human cytochrome P450 reductase with cytochrome c

Tobias M Hedison, Sam Hay, Nigel Scrutton
2015-09-30

Structure and Mechanism of a Viral Collagen Prolyl Hydroxylase

Christopher J. Schofield, Colin W Levy, Christoph Loenarz, Emily Flashman, Sam Hay, Hanna Tarhonskaya, Nigel Scrutton
2015-11-11

Carboxylesterase converts Amplex red to resorufin: Implications for mitochondrial H2O2 release assays

Glyn Nelson, Achim Treumann, Sam Hay, Thomas von Zglinicki
2015-09-23

Dual transcriptional-translational cascade permits cellular level tuneable expression control

Mathew Upton, Sam Hay, Jason Micklefield, Neil Dixon
2015-09-16

Epoxyqueuosine Reductase Structure Suggests a Mechanism for Cobalamin-dependent tRNA Modification

Perdita Barran, Karl A P Payne, Bruno Bellina, Sam Hay

Human - wd:Q42059685

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