Structure-based Virtual Screening Approaches in Kinase-directed Drug Discovery
Bajusz, David, Ferenczy, Gyorgy G, Keseru, Gyorgy M
Published in Current topics in medicinal chemistry (01.08.2017)
Published in Current topics in medicinal chemistry (01.08.2017)
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Contribution of Noncovalent Recognition and Reactivity to the Optimization of Covalent Inhibitors: A Case Study on KRasG12C
Péczka, Nikolett, Ranđelović, Ivan, Orgován, Zoltán, Csorba, Noémi, Egyed, Attila, Petri, László, Ábrányi-Balogh, Péter, Gadanecz, Márton, Perczel, András, Tóvári, József, Schlosser, Gitta, Takács, Tamás, Mihalovits, Levente M., Ferenczy, György G., Buday, László, Keserű, György M.
Published in ACS chemical biology (16.08.2024)
Published in ACS chemical biology (16.08.2024)
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Molecular Mechanism of Labelling Functional Cysteines by Heterocyclic Thiones
Mihalovits, Levente M., Kollár, Levente, Bajusz, Dávid, Knez, Damijan, Bozovičar, Krištof, Imre, Tímea, Ferenczy, György G., Gobec, Stanislav, Keserű, György M.
Published in Chemphyschem (02.01.2024)
Published in Chemphyschem (02.01.2024)
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Optical Trapping Nanometry of Hypermethylated CPG-Island DNA
Pongor, Csaba I., Bianco, Pasquale, Ferenczy, György, Kellermayer, Richárd, Kellermayer, Miklós
Published in Biophysical journal (07.02.2017)
Published in Biophysical journal (07.02.2017)
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Ensemble docking-based virtual screening yields novel spirocyclic JAK1 inhibitors
Bajusz, Dávid, Ferenczy, György G., Keserű, György M.
Published in Journal of molecular graphics & modelling (01.11.2016)
Published in Journal of molecular graphics & modelling (01.11.2016)
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Discovery of isatin and 1H-indazol-3-ol derivatives as d-amino acid oxidase (DAAO) inhibitors
Szilágyi, Bence, Kovács, Péter, Ferenczy, György G., Rácz, Anita, Németh, Krisztina, Visy, Júlia, Szabó, Pál, Ilas, Janez, Balogh, György T., Monostory, Katalin, Vincze, István, Tábi, Tamás, Szökő, Éva, Keserű, György M.
Published in Bioorganic & medicinal chemistry (01.05.2018)
Published in Bioorganic & medicinal chemistry (01.05.2018)
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Glossary of terms used in computational drug design, part II (IUPAC Recommendations 2015)
Martin, Yvonne C., Abagyan, Ruben, Ferenczy, György G., Gillet, Val J., Oprea, Tudor I., Ulander, Johan, Winkler, David, Zefirov, Nicolai S.
Published in Pure and applied chemistry (01.03.2016)
Published in Pure and applied chemistry (01.03.2016)
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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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Design Principles for Fragment Libraries: Maximizing the Value of Learnings from Pharma Fragment-Based Drug Discovery (FBDD) Programs for Use in Academia
Keserű, György M, Erlanson, Daniel A, Ferenczy, György G, Hann, Michael M, Murray, Christopher W, Pickett, Stephen D
Published in Journal of medicinal chemistry (22.09.2016)
Published in Journal of medicinal chemistry (22.09.2016)
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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‑ray Structures
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
Published in Journal of medicinal chemistry (10.01.2019)
Published in Journal of medicinal chemistry (10.01.2019)
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Journal Article
The role of quantum chemistry in covalent inhibitor design
Mihalovits, Levente M., Ferenczy, György G., Keserű, György M.
Published in International journal of quantum chemistry (15.04.2022)
Published in International journal of quantum chemistry (15.04.2022)
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Contribution of hydrophobic interactions to protein mechanical stability
Ferenczy, György G., Kellermayer, Miklós
Published in Computational and structural biotechnology journal (01.01.2022)
Published in Computational and structural biotechnology journal (01.01.2022)
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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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Comparative Study of Allosteric GPCR Binding Sites and Their Ligandability Potential
Peter, Sonja, Siragusa, Lydia, Thomas, Morgan, Palomba, Tommaso, Cross, Simon, O’Boyle, Noel M., Bajusz, Dávid, Ferenczy, György G., Keserű, György M., Bottegoni, Giovanni, Bender, Brian, Chen, Ijen, De Graaf, Chris
Published in Journal of chemical information and modeling (11.11.2024)
Published in Journal of chemical information and modeling (11.11.2024)
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A road map for prioritizing warheads for cysteine targeting covalent inhibitors
Ábrányi-Balogh, Péter, Petri, László, Imre, Tímea, Szijj, Péter, Scarpino, Andrea, Hrast, Martina, Mitrović, Ana, Fonovič, Urša Pečar, Németh, Krisztina, Barreteau, Hélène, Roper, David I., Horváti, Kata, Ferenczy, György G., Kos, Janko, Ilaš, Janez, Gobec, Stanislav, Keserű, György M.
Published in European journal of medicinal chemistry (05.12.2018)
Published in European journal of medicinal chemistry (05.12.2018)
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Covalent Docking in Drug Discovery: Scope and Limitations
Scarpino, Andrea, Ferenczy, György G, Keserű, György M
Published in Current pharmaceutical design (01.01.2020)
Published in Current pharmaceutical design (01.01.2020)
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Force generation by titin folding
Mártonfalvi, Zsolt, Bianco, Pasquale, Naftz, Katalin, Ferenczy, György G., Kellermayer, Miklós
Published in Protein science (01.07.2017)
Published in Protein science (01.07.2017)
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