Publications of Gözde Yalçin-Özkat

Güner, E., Özkan, Ö., Yalçin-Özkat, G., & Ölgen, S. (2024)Determination of Novel SARS-CoV-2 Inhibitors by Combination of Deep Learning, In silico Analysis and Similarity SearchMedicinal Chemistry, 20 (2), 153–231doi: 10.2174/0115734064265609231026063624.

Karacelik, A. A. & Yalçin-Özkat, G. (2023)Mentha longifolia ssp. longifolia Essential Oil Components as Novel Carbonic Anhydrase Isoform i and IX Inhibitors: Biological and Molecular Docking StudiesLetters in Drug Design and Discovery, 20 (6), 767–778doi: 10.2174/1570180819666220510144912.

Yalçin-Özkat, G., Ersan, R. H., Ulger, M., Ulger, S. T., Burmaoglu, S., Yildiz, I., & Algul, O. (2023)Design, synthesis, and computational studies of benzimidazole derivatives as new antitubercular agentsJournal of Biomolecular Structure and Dynamics, 41 (7), 2667–2686doi: 10.1080/07391102.2022.2036241.

Burmaoglu, S., Kazancioglu, E. A., Kazancioglu, M. Z., Sağlamtaş, R., Yalçin-Özkat, G., Gulcin, I., & Algul, O. (2022)Synthesis, molecular docking and some metabolic enzyme inhibition properties of biphenyl-substituted chalcone derivativesJournal of Molecular Structure, 1254, 132358doi: 10.1016/j.molstruc.2022.132358.

Yalçin-Özkat, G. (2022)Computational studies with flavonoids and terpenoids as BRPF1 inhibitors: in silico biological activity prediction, molecular docking, molecular dynamics simulations, MM/PBSA calculationsSAR and QSAR in Environmental Research, 33 (7), 533–550doi: 10.1080/1062936X.2022.2096113.

Yalçin-Özkat, G. (2021)Molecular Modeling Strategies of Cancer Multidrug ResistanceDrug Resistance Updates, 59, 100789doi: 10.1016/j.drup.2021.100789.

Stein, M., Boz, E., & Yalçin-Özkat, G.Accurate Receptor-Ligand Binding Free Energies from Fast QM Conformational Chemical Space SamplingPresented at: 17th German Conference on Cheminformatics and EuroSAMPL Satellite WorkshopGarmisch-Partenkirchen, Germany, May 8, 2022.