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Direct 17O-Isotopic Labeling of Oxides Using Mechanochemistry

Chia-Hsin Chen, Emeline Gaillard, Frédéric Mentink-Vigier, Kuizhi Chen, Zhehong Gan, Philippe Gaveau, Bertrand Rebière, Romain Berthelot, Pierre Florian, Christian Bonhomme, Mark E. Smith, Thomas-Xavier Métro, Bruno Alonso, Danielle Laurencin

Version 1 posted 18 December 2019

532

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Polymer Science

Working Paper

Photocatalytically Active Ladder Polymers

Anastasia Vogel, Mark forster, Liam Wilbraham, Charlotte Smith, Alexander Cowan, Martijn Zwijnenburg, Seb Sprick, Andrew I. Cooper

Version 1 posted 26 November 2018

679

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Theoretical and Computational Chemistry

Working Paper

Sharing Data from Molecular Simulations

Mark J. Abraham, Rossen Apostolov, Jonathan Barnoud, Paul Bauer, Christian Blau, Alexandre M.J.J. Bonvin, matthieu chavent, John Chodera, Karmen Condic-Jurkic, Lucie Delemotte, Helmut Grubmüller, Rebecca J. Howard, E joseph jordan, Erik Lindahl, Samuli Ollila, Jana Selent, Daniel Smith, Phillip J. Stansfeld, Johanna Tiemann, Mikael Trellet, Christopher Woods, Artem Zhmurov

Version 1 posted 09 September 2019

1,245

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Physical Chemistry

Working Paper

Labeling and Probing the Silica Surface Using Mechanochemistry and 17O NMR Spectroscopy

Chia-Hsin Chen, Frederic Mentink-Vigier, Julien Trébosc, Ieva Goldberga, Philippe Gaveau, Emilie Thomassot, Dinu Iuga, Mark E. Smith, Kuizhi Chen, Zhehong Gan, Nicolas Fabrègue, Thomas-Xavier Métro, Bruno Alonso, Danielle Laurencin

Version 1 posted 15 April 2021

398

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Biological and Medicinal Chemistry

Working Paper

Strategic Fluorination to Achieve a Potent, Selective, Metabolically-Stable, and Orally-Bioavailable Inhibitor of CSNK2.

Han Wee Ong, Xuan Yang, Jeffery Smith, Sharon Taft-Benz, Stefanie Howell, Rebekah Dickmander, Tammy Havener, Marcia Sanders, Jason Brown, Rafael Couñago, Edcon Chang, Andreas Krämer, Nathaniel Moorman, Mark Heise, Alison Axtman, David Drewry, Timothy Willson

Version 1 posted 22 July 2024

125

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Biological and Medicinal Chemistry

Working Paper

More than an Amide Bioisostere: Discovery of 1,2,4-Triazole-containing Pyrazolo[1,5-a]pyrimidine Host CSNK2 Inhibitors for Combatting β-Coronavirus Replication

Han Wee Ong, Xuan Yang, Jeffery Smith, Rebekah Dickmander, Jason Brown, Tammy Havener, Sharon Taft-Benz, Stefanie Howell, Marcia Sanders, Jacob Capener, Rafael Couñago, Edcon Chang, Andreas Krämer, Nathaniel Moorman, Mark Heise, Alison Axtman, David Drewry, Timothy Willson

Version 1 posted 24 April 2024

273

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Theoretical and Computational Chemistry

Working Paper

Reactive Quantum-Mechanical Molecular Dynamics Simulations to Reveal Mechanisms of Enzyme Catalysis

Rae Ann Corrigan Grove, Michael A. Moxley, Christian F. A. Negre, Marc J. Cawkwell, Anders M. N. Niklasson, Susan M. Mniszewski, Nathan Smith, Kevin Prososki, Mark A. Wilson, Michael E. Wall

Version 4 posted 12 March 2025

248

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Organic Chemistry

Working Paper

The Enantioselective Organocatalytic [1,2]-Rearrangement of Allylic Ammonium Ylides

Will Hartley, Mark Greenhalgh, Kevin Kasten, Taisiia Feoktistova, Henry Wise, Jacqueline Laddusaw, Aileen Frost, Sean Ng, Alexandra Slawin, Bela Bode, Paul Ha-Yeon Cheong, Andrew Smith

Version 2 posted 07 February 2024

1,056

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1

Citations

Biological and Medicinal Chemistry

Working Paper

Identification and Utilization of a Chemical Probe to Interrogate the Roles of PIKfyve in the Lifecycle of β-Coronaviruses

David H. Drewry, Frances M. Potjewyd, Jeffrey L. Smith, Rebekah J. Dickmander, Armin Bayati, Stefanie Howell, Sharon A. Taft-Benz, Mohammad Anwar Hossain, Mark T. Heise, Peter S. McPherson, Nathaniel J. Moorman, Alison D. Axtman

Version 1 posted 27 April 2022

251

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Analytical Chemistry

Working Paper

Temperature-induced mobility in Octacalcium Phosphate impacts crystal symmetry: water dynamics studied by NMR crystallography

Adam Nelson, Wassilios Papawassiliou, Subhradip Paul, Sabine Hediger, Ivan Hung, Zhehong Gan, Amrit Venkatesh, W. Trent Franks, Mark E. Smith, David Gajan, Gaël De Paëpe, Christian Bonhomme, Danielle Laurencin, Christel Gervais

Version 2 posted 29 May 2024

285

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Refine Search

13 results in Mark Smith in Authors: Mark Smith

Direct 17O-Isotopic Labeling of Oxides Using Mechanochemistry

Photocatalytically Active Ladder Polymers

Sharing Data from Molecular Simulations

Labeling and Probing the Silica Surface Using Mechanochemistry and 17O NMR Spectroscopy

Strategic Fluorination to Achieve a Potent, Selective, Metabolically-Stable, and Orally-Bioavailable Inhibitor of CSNK2.

More than an Amide Bioisostere: Discovery of 1,2,4-Triazole-containing Pyrazolo[1,5-a]pyrimidine Host CSNK2 Inhibitors for Combatting β-Coronavirus Replication

Reactive Quantum-Mechanical Molecular Dynamics Simulations to Reveal Mechanisms of Enzyme Catalysis

The Enantioselective Organocatalytic [1,2]-Rearrangement of Allylic Ammonium Ylides

Identification and Utilization of a Chemical Probe to Interrogate the Roles of PIKfyve in the Lifecycle of β-Coronaviruses

Temperature-induced mobility in Octacalcium Phosphate impacts crystal symmetry: water dynamics studied by NMR crystallography

13 results in Authors: Mark Smith