| Rings in Clinical Trials and Drugs: Present and Future J Shearer, JL Castro, ADG Lawson, M MacCoss, RD Taylor Journal of Medicinal Chemistry, 2022 | 208 | 2022 |
| Role of O-Antigen in Response to Mechanical Stress of the E. coli Outer Membrane: Insights from Coarse-Grained MD Simulations D Jefferies, J Shearer, S Khalid The Journal of Physical Chemistry B 123 (17), 3567-3575, 2019 | 60 | 2019 |
| It Is Complicated: Curvature, Diffusion, and Lipid Sorting within the Two Membranes of Escherichia coli PC Hsu, F Samsudin, J Shearer, S Khalid The journal of physical chemistry letters 8 (22), 5513-5518, 2017 | 60 | 2017 |
| Outer membrane proteins OmpA, FhuA, OmpF, EstA, BtuB, and OmpX have unique lipopolysaccharide fingerprints J Shearer, D Jefferies, S Khalid Journal of chemical theory and computation 15 (4), 2608-2619, 2019 | 56 | 2019 |
| Communication between the leaflets of asymmetric membranes revealed from coarse-grain molecular dynamics simulations J Shearer, S Khalid Scientific reports 8 (1), 1-6, 2018 | 33 | 2018 |
| Molecular dynamics simulations of bacterial outer membrane lipid extraction: Adequate sampling? J Shearer, JK Marzinek, PJ Bond, S Khalid The Journal of Chemical Physics 153 (4), 044122, 2020 | 18 | 2020 |
| Structure-based modeling and dynamics of MurM, a Streptococcus pneumoniae penicillin resistance determinant present at the cytoplasmic membrane A York, AJ Lloyd, CI Del Genio, J Shearer, KJ Hinxman, K Fritz, V Fulop, ... Structure 29 (7), 731-742. e6, 2021 | 10 | 2021 |
| Multiple cascade radiation damage simulations of pyrochlore A Archer, HR Foxhall, NL Allan, JRW Shearer, DSD Gunn, JH Harding, ... Molecular Simulation 47 (2-3), 273-283, 2021 | 3 | 2021 |
| Structure-based modelling and dynamics of MurM, a Streptococcus pneumoniae penicillin resistance determinant that functions at the cytoplasmic membrane interface A York, AJ Lloyd, CI del Genio, J Shearer, KJ Hinxman, K Fritz, V Fulop, ... Available at SSRN 3641935, 2020 | | 2020 |
| The effects of model membrane complexity for the E.coli cell envelope J Shearer University of Southampton, 2020 | | 2020 |
| Molecular choreography within the bacterial cell envelope: Insights from molecular dynamics simulations S Khalid, F Samsudin, A Boags, J Shearer ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 257, 2019 | | 2019 |
| The Flow of Proteins and Idealised Pores within the Membranes of Gram-Negative Bacteria J Shearer, S Khalid Biophysical Journal 114 (3), 613a, 2018 | | 2018 |
Firdaus SamsudinResearch Fellow, Bioinformatics Institute, A*STAREmail verificata su bii.a-star.edu.sg