Search Results - "Kirton, Stewart B"
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Polymers Exhibiting Lower Critical Solution Temperatures as a Route to Thermoreversible Gelators for Healthcare
Published in Advanced functional materials (01-02-2021)“…The ability to trigger changes to material properties with external stimuli, so‐called “smart” behavior, has enabled novel technologies for a wide range of…”
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New inhibitor targeting human transcription factor HSF1: effects on the heat shock response and tumor cell survival
Published in Nucleic acids research (02-06-2017)“…Comparative modeling of the DNA-binding domain of human HSF1 facilitated the prediction of possible binding pockets for small molecules and definition of…”
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The Influence of Oily Vehicle Composition and Vehicle-Membrane Interactions on the Diffusion of Model Permeants across Barrier Membranes
Published in Membranes (Basel) (14-01-2021)“…In many instances, one or more components of a pharmaceutical or cosmetic formulation is an oil. The aims of this study were two-fold. First, to examine the…”
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Multivariate Analytical Approaches to Identify Key Molecular Properties of Vehicles, Permeants and Membranes That Affect Permeation through Membranes
Published in Pharmaceutics (11-10-2020)“…There has been considerable recent interest in employing computer models to investigate the relationship between the structure of a molecule and its dermal…”
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The benefits of in silico modeling to identify possible small-molecule drugs and their off-target interactions
Published in Future medicinal chemistry (01-02-2018)“…The research into the use of small molecules as drugs continues to be a key driver in the development of molecular databases, computer-aided drug design…”
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Revisiting the General Solubility Equation: In Silico Prediction of Aqueous Solubility Incorporating the Effect of Topographical Polar Surface Area
Published in Journal of chemical information and modeling (27-02-2012)“…The General Solubility Equation (GSE) is a QSPR model based on the melting point and log P of a chemical substance. It is used to predict the aqueous…”
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NPS detection in prison: A systematic literature review of use, drug form, and analytical approaches
Published in Drug testing and analysis (01-08-2022)“…This paper presents a systematic literature review on the detection of new psychoactive substances (NPS) in prison settings. It includes the most frequently…”
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Thermoresponsive Triblock‐Copolymers of Polyethylene Oxide and Polymethacrylates: Linking Chemistry, Nanoscale Morphology, and Rheological Properties
Published in Advanced functional materials (01-02-2022)“…Thermoreversible gels switch from a free‐flowing liquid state to an elastic gel mesophase upon warming, displaying the reverse transition upon cooling. While…”
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A drug-incorporated-microparticle-eggshell-membrane-scaffold (DIMES) dressing: A novel biomaterial for localised wound regeneration
Published in European journal of pharmaceutics and biopharmaceutics (01-09-2023)“…[Display omitted] Chronic wounds affect millions of people annually and have emotional and financial implications in addition to health issues. The current…”
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Discovery of novel small molecule inhibitors of S100P with in vitro anti-metastatic effects on pancreatic cancer cells
Published in European journal of medicinal chemistry (01-10-2020)“…S100P, a calcium-binding protein, is known to advance tumor progression and metastasis in pancreatic and several other cancers. Herein is described the in…”
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The eggshell membrane: A potential biomaterial for corneal wound healing
Published in Journal of biomaterials applications (01-11-2021)“…The eggshell membrane (ESM) is an abundant resource with innate complex structure and composition provided by nature. With at least 60 million tonnes of hen…”
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In Silico Prediction of Aqueous Solubility Using Simple QSPR Models: The Importance of Phenol and Phenol-like Moieties
Published in Journal of chemical information and modeling (26-11-2012)“…Recently the authors published a robust QSPR model of aqueous solubility which exploited the computationally derived molecular descriptor topographical polar…”
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Predicting the Fine Particle Fraction of Dry Powder Inhalers Using Artificial Neural Networks
Published in Journal of pharmaceutical sciences (01-01-2017)“…Dry powder inhalers are increasingly popular for delivering drugs to the lungs for the treatment of respiratory diseases, but are complex products with…”
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Polymer Architecture Effects on Poly(N,N‐Diethyl Acrylamide)‐b‐Poly(Ethylene Glycol)‐b‐Poly(N,N‐Diethyl Acrylamide) Thermoreversible Gels and Their Evaluation as a Healthcare Material
Published in Macromolecular bioscience (01-03-2022)“…Thermoreversible gels which transition between liquid‐like and solid‐like states when warmed have enabled significant novel healthcare technologies…”
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In Silico Investigations into the Selectivity of Psychoactive and New Psychoactive Substances in Monoamine Transporters
Published in ACS omega (01-11-2022)“…New psychoactive substances (NPS) are a group of compounds that mimic the effects of illicit substances. A range of NPS have been shown to interact with the…”
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Detection of newly emerging psychoactive substances using Raman spectroscopy and chemometrics
Published in RSC advances (01-01-2018)“…A novel approach for the identification of New Psychoactive Substances (NPS) by means of Raman spectroscopy coupled with Principal Components Analysis (PCA)…”
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Elemental fingerprinting of Hypericum perforatum (St John’s Wort) herb and preparations using ICP-OES and chemometrics
Published in Journal of pharmaceutical and biomedical analysis (05-06-2016)“…[Display omitted] •Evaluation of 54 samples (i.e., herb, capsule and tablet) from worldwide origin.•The elemental profile plus PCA delineated between herb,…”
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Using Structured Chemistry Examinations (SChemEs) As an Assessment Method To Improve Undergraduate Students’ Generic, Practical, and Laboratory-Based Skills
Published in Journal of chemical education (13-05-2014)“…Increase in tuition fees means there will be renewed pressure on universities to provide “value for money” courses that provide extensive training in both…”
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Drowning in diversity? A systematic way of clustering and selecting a representative set of new psychoactive substances
Published in RSC advances (2017)“…New psychoactive substances (NPS) can be generally described as a set of compounds that have been designed to mimic the effects of illegal recreational drugs,…”
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Establishing the importance of oil-membrane interactions on the transmembrane diffusion of physicochemically diverse compounds
Published in International journal of pharmaceutics (15-06-2016)“…[Display omitted] The diffusion process through a non-porous barrier membrane depends on the properties of the drug, vehicle and membrane. The aim of the…”
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