Comparative Evaluation of Covalent Docking Tools
Scarpino, Andrea, Ferenczy, György G, Keserű, György M
Published in Journal of chemical information and modeling (23.07.2018)
Published in Journal of chemical information and modeling (23.07.2018)
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Expanding the medicinal chemistry synthetic toolbox
Boström, Jonas, Brown, Dean G, Young, Robert J, Keserü, György M
Published in Nature reviews. Drug discovery (01.10.2018)
Published in Nature reviews. Drug discovery (01.10.2018)
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The influence of lead discovery strategies on the properties of drug candidates
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Book Review
Finding the sweet spot: the role of nature and nurture in medicinal chemistry
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Book Review
Catalytic Mechanism and Covalent Inhibition of UDP‑N‑Acetylglucosamine Enolpyruvyl Transferase (MurA): Implications to the Design of Novel Antibacterials
Mihalovits, Levente M, Ferenczy, György G, Keserű, György M
Published in Journal of chemical information and modeling (23.12.2019)
Published in Journal of chemical information and modeling (23.12.2019)
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The role of ligand efficiency metrics in drug discovery
Hopkins, Andrew L, Keserü, György M, Leeson, Paul D, Rees, David C, Reynolds, Charles H
Published in Nature reviews. Drug discovery (01.02.2014)
Published in Nature reviews. Drug discovery (01.02.2014)
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Book Review
Why Some Targets Benefit from beyond Rule of Five Drugs
Egbert, Megan, Whitty, Adrian, Keserű, György M, Vajda, Sandor
Published in Journal of medicinal chemistry (27.11.2019)
Published in Journal of medicinal chemistry (27.11.2019)
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Electrophilic MiniFrags Revealed Unprecedented Binding Sites for Covalent HDAC8 Inhibitors
Keeley, Aaron B., Kopranovic, Aleksandra, Di Lorenzo, Vincenzo, Ábrányi-Balogh, Péter, Jänsch, Niklas, Lai, Linh N., Petri, László, Orgován, Zoltán, Pölöske, Daniel, Orlova, Anna, Németh, András György, Desczyk, Charlotte, Imre, Tímea, Bajusz, Dávid, Moriggl, Richard, Meyer-Almes, Franz-Josef, Keserü, György M.
Published in Journal of medicinal chemistry (11.01.2024)
Published in Journal of medicinal chemistry (11.01.2024)
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Journal Article
Validity of Ligand Efficiency Metrics
Murray, Christopher W, Erlanson, Daniel A, Hopkins, Andrew L, Keserü, György M, Leeson, Paul D, Rees, David C, Reynolds, Charles H, Richmond, Nicola J
Published in ACS medicinal chemistry letters (12.06.2014)
Published in ACS medicinal chemistry letters (12.06.2014)
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Crystallographic and electrophilic fragment screening of the SARS-CoV-2 main protease
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
Published in Nature communications (07.10.2020)
Published in Nature communications (07.10.2020)
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In silico site of metabolism prediction of cytochrome P450-mediated biotransformations
Tarcsay, Ákos, Keseru, György M
Published in Expert opinion on drug metabolism & toxicology (01.03.2011)
Published in Expert opinion on drug metabolism & toxicology (01.03.2011)
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Identification of Novel Histamine H4 Ligands by Virtual Screening on Molecular Dynamics Ensembles
Kiss, Róbert, Jójárt, Balázs, Schmidt, Éva, Kiss, Béla, Keserű, György M.
Published in Molecular informatics (01.04.2014)
Published in Molecular informatics (01.04.2014)
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