Search Results - "Carbery, Anna"

Crystallographic and electrophilic fragment screening of the SARS-CoV-2 main protease by Douangamath, Alice, Fearon, Daren, Gehrtz, Paul, Krojer, Tobias, Lukacik, Petra, Owen, C. David, Resnick, Efrat, Strain-Damerell, Claire, Aimon, Anthony, Ábrányi-Balogh, Péter, Brandão-Neto, José, Carbery, Anna, Davison, Gemma, Dias, Alexandre, Downes, Thomas D., Dunnett, Louise, Fairhead, Michael, Firth, James D., Jones, S. Paul, Keeley, Aaron, Keserü, György M., Klein, Hanna F., Martin, Mathew P., Noble, Martin E. M., O’Brien, Peter, Powell, Ailsa, Reddi, Rambabu N., Skyner, Rachael, Snee, Matthew, Waring, Michael J., Wild, Conor, London, Nir, von Delft, Frank, Walsh, Martin A.

“…COVID-19, caused by SARS-CoV-2, lacks effective therapeutics. Additionally, no antiviral drugs or vaccines were developed against the closely related…”
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Learnt representations of proteins can be used for accurate prediction of small molecule binding sites on experimentally determined and predicted protein structures by Carbery, Anna, Buttenschoen, Martin, Skyner, Rachael, von Delft, Frank, Deane, Charlotte M.

“…Protein-ligand binding site prediction is a useful tool for understanding the functional behaviour and potential drug-target interactions of a novel protein of…”
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Fragment Libraries Designed to Be Functionally Diverse Recover Protein Binding Information More Efficiently Than Standard Structurally Diverse Libraries by Carbery, Anna, Skyner, Rachael, von Delft, Frank, Deane, Charlotte M.

“…Current fragment-based drug design relies on the efficient exploration of chemical space by using structurally diverse libraries of small fragments. However,…”
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Ribosome occupancy profiles are conserved between structurally and evolutionarily related yeast domains by Nissley, Daniel A, Carbery, Anna, Chonofsky, Mark, Deane, Charlotte M

“…Abstract Motivation Protein synthesis is a non-equilibrium process, meaning that the speed of translation can influence the ability of proteins to fold and…”
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A Small Step Toward Generalizability: Training a Machine Learning Scoring Function for Structure-Based Virtual Screening by Scantlebury, Jack, Vost, Lucy, Carbery, Anna, Hadfield, Thomas E., Turnbull, Oliver M., Brown, Nathan, Chenthamarakshan, Vijil, Das, Payel, Grosjean, Harold, von Delft, Frank, Deane, Charlotte M.

“…Over the past few years, many machine learning-based scoring functions for predicting the binding of small molecules to proteins have been developed. Their…”
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Pregnancy and inflammatory bowel disease: Do we provide enough patient education? A British study of 1324 women by Carbery, Isabel, Ghorayeb, Jihane, Madill, Anna, Selinger, Christian P

“…AIM To examine patient knowledge and factors influencing knowledge about pregnancy in British women with inflammatory bowel disease(IBD).METHODS This is a post…”
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