Comparative Evaluation of Covalent Docking Tools von Scarpino, Andrea, Ferenczy, György G, Keserű, György M

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Expanding the medicinal chemistry synthetic toolbox von Boström, Jonas, Brown, Dean G., Young, Robert J., Keserü, György M.

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GPCRdb in 2021: integrating GPCR sequence, structure and function von Kooistra, Albert J, Mordalski, Stefan, Pándy-Szekeres, Gáspár, Esguerra, Mauricio, Mamyrbekov, Alibek, Munk, Christian, Keserű, György M, Gloriam, David E

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Design Principles for Fragment Libraries: Maximizing the Value of Learnings from Pharma Fragment-Based Drug Discovery (FBDD) Programs for Use in Academia von Keserű, György M, Erlanson, Daniel A, Ferenczy, György G, Hann, Michael M, Murray, Christopher W, Pickett, Stephen D

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Affinity and Selectivity Assessment of Covalent Inhibitors by Free Energy Calculations von Mihalovits, Levente M, Ferenczy, György G, Keserű, György M

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Impact of Lipophilic Efficiency on Compound Quality von Tarcsay, Ákos, Nyíri, Kinga, Keserű, György M

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The G protein database, GproteinDb von Pándy-Szekeres, Gáspár, Esguerra, Mauricio, Hauser, Alexander S, Caroli, Jimmy, Munk, Christian, Pilger, Steven, Keserű, György M, Kooistra, Albert J, Gloriam, David E

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The influence of lead discovery strategies on the properties of drug candidates von Keserü, György M, Makara, Gergely M

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Structure-Based Optimization Strategies for G Protein-Coupled Receptor (GPCR) Allosteric Modulators: A Case Study from Analyses of New Metabotropic Glutamate Receptor 5 (mGlu5) X‑r... von Christopher, John A, Orgován, Zoltán, Congreve, Miles, Doré, Andrew S, Errey, James C, Marshall, Fiona H, Mason, Jonathan S, Okrasa, Krzysztof, Rucktooa, Prakash, Serrano-Vega, Maria J, Ferenczy, György G, Keserű, György M

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The role of ligand efficiency metrics in drug discovery von Hopkins, Andrew L., Keserü, György M., Leeson, Paul D., Rees, David C., Reynolds, Charles H.

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Catalytic Mechanism and Covalent Inhibition of UDP‑N‑Acetylglucosamine Enolpyruvyl Transferase (MurA): Implications to the Design of Novel Antibacterials von Mihalovits, Levente M, Ferenczy, György G, Keserű, György M

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Small molecule inhibitors of RAS proteins with oncogenic mutations von Orgovan, Zoltan, Keseru, Gyorgy M.

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Vinylation of α‑Aminoazoles with Triethylamine: A General Strategy to Construct Azolo[1,5‑a]pyrimidines with a Nonsubstituted Ethylidene Fragment von Gao, Qinghe, Sun, Zhenhua, Xia, Qinfei, Li, Ruonan, Wang, Wenlong, Ma, Siwei, Chai, Yixin, Wu, Manman, Hu, Wei, Ábrányi-Balogh, Péter, Keserű, György M, Han, Xinya

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Fully Flexible Low-Mode Docking:  Application to Induced Fit in HIV Integrase von Keserû, György M, Kolossváry, István

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Finding the sweet spot: the role of nature and nurture in medicinal chemistry von Hann, Michael M., Keserü, György M.

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Conservation of Allosteric Ligand Binding Sites in G‑Protein Coupled Receptors von Wakefield, Amanda E., Bajusz, Dávid, Kozakov, Dima, Keserű, György M., Vajda, Sandor

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Direct Targeting Options for STAT3 and STAT5 in Cancer von Orlova, Anna, Wagner, Christina, de Araujo, Elvin D, Bajusz, Dávid, Neubauer, Heidi A, Herling, Marco, Gunning, Patrick T, Keserű, György M, Moriggl, Richard

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Virtual Fragment Docking by Glide: a Validation Study on 190 Protein−Fragment Complexes von Sándor, Márk, Kiss, Róbert, Keserű, György M

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Contributions of molecular properties to drug promiscuity von Tarcsay, Ákos, Keserű, György M

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Thermodynamics guided lead discovery and optimization von Ferenczy, György G., Keserű, György M.

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