| Mechanism of phosphatidylglycerol activation catalyzed by prolipoprotein diacylglyceryl transferase W Singh, M Bilal, J McClory, D Dourado, D Quinn, TS Moody, I Sutcliffe, ... The Journal of Physical Chemistry B 123 (33), 7092-7102, 2019 | 12 | 2019 |
| Reaction mechanism of isopentenyl phosphate kinase: a QM/MM study J McClory, DJ Timson, W Singh, J Zhang, M Huang The Journal of Physical Chemistry B 121 (49), 11062-11071, 2017 | 12 | 2017 |
| Phosphorylation mechanism of phosphomevalonate kinase: Implications for rational engineering of isoprenoid biosynthetic pathway enzymes M Huang, K Wei, X Li, J McClory, G Hu, JW Zou, D Timson The Journal of Physical Chemistry B 120 (41), 10714-10722, 2016 | 11 | 2016 |
| Catalytic mechanism of mevalonate kinase revisited, a QM/MM study J McClory, JT Lin, DJ Timson, J Zhang, M Huang Organic & Biomolecular Chemistry 17 (9), 2423-2431, 2019 | 10 | 2019 |
| The phosphorylation mechanism of mevalonate diphosphate decarboxylase: a QM/MM study J McClory, C Hui, J Zhang, M Huang Organic & Biomolecular Chemistry 18 (3), 518-529, 2020 | 6 | 2020 |
| Phosphorylation Mechanism of N-Acetyl-l-glutamate Kinase, a QM/MM Study J McClory, GX Hu, JW Zou, DJ Timson, M Huang The Journal of Physical Chemistry B 123 (13), 2844-2852, 2019 | 6 | 2019 |
| A disappearing act performed by magnesium: the nucleotide exchange mechanism of Ran GTPase by quantum mechanics/molecular mechanics studies MC Mooney, Y Xu, J McClory, M Huang Theoretical Chemistry Accounts 135, 1-13, 2016 | 4 | 2016 |
| Water-mediated network in the resistance mechanism of fosfomycin J McClory, JT Lin, DJ Timson, J Zhang, M Huang Physical Chemistry Chemical Physics 20 (33), 21660-21667, 2018 | 3 | 2018 |
| Applications and challenges in designing VHH-based bispecific antibodies: leveraging machine learning solutions M Mullin, J McClory, W Haynes, J Grace, N Robertson, G van Heeke Mabs 16 (1), 2341443, 2024 | | 2024 |
| Elucidating the Reaction Mechanisms of Mevalonate Pathway Enzymes Using Quantum Mechanics/molecular Mechanics Methods JB McClory Queen's University Belfast. Faculty of Engineering and Physical Sciences, July, 2019 | | 2019 |
