Revisiting the General Solubility Equation: In Silico Prediction of Aqueous Solubility Incorporating the Effect of Topographical Polar Surface Area J Ali, P Camilleri, MB Brown, AJ Hutt, SB Kirton Journal of chemical information and modeling 52 (2), 420-428, 2012 | 300 | 2012 |
Polymers exhibiting lower critical solution temperatures as a route to thermoreversible gelators for healthcare MT Cook, P Haddow, SB Kirton, WJ McAuley Advanced Functional Materials 31 (8), 2008123, 2021 | 168 | 2021 |
Prediction of binding modes for ligands in the cytochromes P450 and other heme‐containing proteins SB Kirton, CW Murray, ML Verdonk, RD Taylor Proteins: Structure, Function, and Bioinformatics 58 (4), 836-844, 2005 | 124 | 2005 |
Objective structured clinical examinations (OSCEs) compared with traditional assessment methods SB Kirton, L Kravitz American journal of pharmaceutical education 75 (6), 111, 2011 | 112 | 2011 |
In Silico Prediction of Aqueous Solubility Using Simple QSPR Models: The Importance of Phenol and Phenol-like Moieties J Ali, P Camilleri, MB Brown, AJ Hutt, SB Kirton Journal of chemical information and modeling 52 (11), 2950-2957, 2012 | 98 | 2012 |
Impact of incorporating the 2C5 crystal structure into comparative models of cytochrome P450 2D6 SB Kirton, CA Kemp, NP Tomkinson, S St.‐Gallay, MJ Sutcliffe Proteins: Structure, Function, and Bioinformatics 49 (2), 216-231, 2002 | 95 | 2002 |
In silico methods for predicting ligand binding determinants of cytochromes P450 MJ de Groot, SB Kirton, MJ Sutcliffe Current topics in medicinal chemistry 4 (16), 1803-1824, 2004 | 81 | 2004 |
Comparative modelling of cytochromes P450 SB Kirton, CA Baxter, MJ Sutcliffe Advanced drug delivery reviews 54 (3), 385-406, 2002 | 75 | 2002 |
New inhibitor targeting human transcription factor HSF1: effects on the heat shock response and tumor cell survival N Vilaboa, A Boré, F Martin-Saavedra, M Bayford, N Winfield, ... Nucleic acids research 45 (10), 5797-5817, 2017 | 74 | 2017 |
Intended and unintended use of cathinone mixtures A Guirguis, JM Corkery, JL Stair, SB Kirton, M Zloh, F Schifano Human Psychopharmacology: Clinical and Experimental 32 (3), e2598, 2017 | 66 | 2017 |
The eggshell membrane: A potential biomaterial for corneal wound healing RA Mensah, SB Jo, H Kim, SM Park, KD Patel, KJ Cho, MT Cook, ... Journal of biomaterials applications 36 (5), 912-929, 2021 | 50 | 2021 |
The Benefits of In Silico Modeling to Identify Possible Small-Molecule Drugs and Their Off-Target Interactions M Zloh, SB Kirton Future medicinal chemistry 10 (4), 423-432, 2018 | 45 | 2018 |
Optimising poly (lactic-co-glycolic acid) microparticle fabrication using a Taguchi orthogonal array design-of-experiment approach RA Mensah, SB Kirton, MT Cook, ID Styliari, V Hutter, DYS Chau PLoS One 14 (9), e0222858, 2019 | 39 | 2019 |
NPS detection in prison: A systematic literature review of use, drug form, and analytical approaches G Vaccaro, A Massariol, A Guirguis, SB Kirton, JL Stair Drug testing and analysis 14 (8), 1350-1367, 2022 | 36 | 2022 |
Using structured chemistry examinations (SChemEs) as an assessment method to improve undergraduate students’ generic, practical, and laboratory-based skills SB Kirton, A Al-Ahmad, S Fergus Journal of Chemical Education 91 (5), 648-654, 2014 | 36 | 2014 |
Elemental fingerprinting of Hypericum perforatum (St John’s Wort) herb and preparations using ICP-OES and chemometrics JD Owen, SB Kirton, SJ Evans, JL Stair Journal of pharmaceutical and biomedical analysis 125, 15-21, 2016 | 33 | 2016 |
Discovery of novel small molecule inhibitors of S100P with in vitro anti-metastatic effects on pancreatic cancer cells R Camara, D Ogbeni, L Gerstmann, M Ostovar, E Hurer, M Scott, ... European journal of medicinal chemistry 203, 112621, 2020 | 30 | 2020 |
SkelGen: a general tool for structure-based de novo ligand design PM Dean, S Firth-Clark, W Harris, SB Kirton, NP Todorov Expert opinion on drug discovery 1 (2), 179-189, 2006 | 29 | 2006 |
Detection of newly emerging psychoactive substances using Raman spectroscopy and chemometrics J Calvo-Castro, A Guirguis, EG Samaras, M Zloh, SB Kirton, JL Stair RSC advances 8 (56), 31924-31933, 2018 | 27 | 2018 |
Predicting the fine particle fraction of dry powder inhalers using artificial neural networks J Muddle, SB Kirton, I Parisini, A Muddle, D Murnane, J Ali, M Brown, ... Journal of Pharmaceutical Sciences 106 (1), 313-321, 2017 | 25 | 2017 |