James Smith

Affiliations: 
University of Leeds (United Kingdom) 
Area:
Computational Biology, Structure-based Drug Design, Drug Design, Computational Chemistry, Medicinal Chemistry
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"James Smith"
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Publications

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Burley SK, Bhatt R, Bhikadiya C, et al. (2024) Updated resources for exploring experimentally-determined PDB structures and Computed Structure Models at the RCSB Protein Data Bank. Nucleic Acids Research
Hsu SN, Hui EWE, Liu M, et al. (2024) Correction: Revealing nuclear receptor hub modules from Basal-like breast cancer expression networks. Plos One. 19: e0314424
Morris R, Chappell HF, Scott AJ, et al. (2024) Ab Initio Molecular Dynamics Simulations of Phosphocholine Interactions with a Calcium Oxalate Dihydrate (110) Surface. Crystal Growth & Design. 24: 8063-8075
Hills OJ, Noble IOK, Heyam A, et al. (2023) Atomistic modelling and NMR studies reveal that gallium can target the ferric PQS uptake system in biofilms. Microbiology (Reading, England). 169
Hills OJ, Poskrobko Z, Scott AJ, et al. (2023) A DFT study of the gallium ion-binding capacity of mature Pseudomonas aeruginosa biofilm extracellular polysaccharide. Plos One. 18: e0287191
Hills OJ, Yong CW, Scott AJ, et al. (2022) Polyguluronate simulations shed light onto the therapeutic action of OligoG CF-5/20. Bioorganic & Medicinal Chemistry. 72: 116945
Hills OJ, Yong CW, Scott AJ, et al. (2022) Atomic-scale interactions between quorum sensing autoinducer molecules and the mucoid P. aeruginosa exopolysaccharide matrix. Scientific Reports. 12: 7724
Hills OJ, Smith J, Scott AJ, et al. (2021) Cation complexation by mucoid Pseudomonas aeruginosa extracellular polysaccharide. Plos One. 16: e0257026
Hsu SN, Hui EWE, Liu M, et al. (2021) Revealing nuclear receptor hub modules from Basal-like breast cancer expression networks. Plos One. 16: e0252901
Lewis TE, Sillitoe I, Andreeva A, et al. (2013) Genome3D: a UK collaborative project to annotate genomic sequences with predicted 3D structures based on SCOP and CATH domains. Nucleic Acids Research. 41: D499-507
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