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Leighton Coates

Oak Ridge National Laboratory
University of Southampton

200

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High-Throughput Virtual Screening and Validation of a SARS-CoV-2 Main Protease Noncovalent Inhibitor.

2022 J. Chem. Inf. Model.
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Toho-1 β-lactamase: backbone chemical shift assignments and changes in dynamics upon binding with avibactam

2021 Journal of Biomolecular NMR
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High Throughput Virtual Screening and Validation of a SARS-CoV-2 Main Protease Non-Covalent Inhibitor

2021 bioRxiv
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Water structure around a left-handed Z-DNA fragment analyzed by cryo neutron crystallography.

2021 Nucleic Acids Research
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High Throughput Virtual Screening and Validation of a SARS-CoV-2 Main Protease Non-Covalent Inhibitor

2021 Journal of Chemical Information and Modeling
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Inhibitor Binding Modulates Protonation States in the Active Site of SARS-CoV-2 Main Protease

2021 bioRxiv
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Direct visualization of SARS-CoV-2 main protease electrostatics using neutron crystallography

2021 Acta Crystallographica Section A
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Conformational Dynamics in the Interaction of SARS-CoV-2 Papain-like Protease with Human Interferon-Stimulated Gene 15 Protein.

2021 Journal of Physical Chemistry Letters
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Inhibitor binding influences the protonation states of histidines in SARS-CoV-2 main protease

2021 Chemical Science
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Visualization of the constellation of protons in the product-inhibited state of human manganese superoxide dismutase

2021 Acta Crystallographica Section A
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