| Thermott: a comprehensive online tool for protein–ligand binding constant determination M Gedgaudas, D Baronas, E Kazlauskas, V Petrauskas, D Matulis Drug Discovery Today 27 (8), 2076-2079, 2022 | 28 | 2022 |
| Intrinsic thermodynamics of high affinity inhibitor binding to recombinant human carbonic anhydrase IV A Mickevičiūtė, DD Timm, M Gedgaudas, V Linkuvienė, Z Chen, ... European Biophysics Journal 47, 271-290, 2018 | 23 | 2018 |
| PLBD: protein–ligand binding database of thermodynamic and kinetic intrinsic parameters D Lingė, M Gedgaudas, A Merkys, V Petrauskas, A Vaitkus, A Grybauskas, ... Database 2023, baad040, 2023 | 13 | 2023 |
| Benzimidazole design, synthesis, and docking to build selective carbonic anhydrase VA inhibitors E Čapkauskaitė, A Zakšauskas, V Ruibys, V Linkuvienė, V Paketurytė, ... Bioorganic & Medicinal Chemistry 26 (3), 675-687, 2018 | 13 | 2018 |
| Thermal shift assay for protein–ligand dissociation constant determination V Petrauskas, E Kazlauskas, M Gedgaudas, L Baranauskienė, A Zubrienė, ... TrAC Trends in Analytical Chemistry, 117417, 2023 | 12 | 2023 |
| New class of hsp90 c-terminal domain inhibitors with anti-tumor properties against triple-negative breast cancer Z Zajec, J Dernovšek, J Cingl, I Ogris, M Gedgaudas, A Zubriene, ... Journal of medicinal chemistry, 2024 | 5 | 2024 |
| Comprehensive analysis of resorcinyl-imidazole Hsp90 inhibitor design M Gedgaudas, P Kaziukonytė, V Kairys, A Mickevičiūtė, A Zubrienė, ... European Journal of Medicinal Chemistry 273, 116505, 2024 | 5 | 2024 |
| Exploration and optimisation of structure-activity relationships of new triazole-based C-terminal Hsp90 inhibitors towards in vivo anticancer potency J Dernovšek, Ž Zajec, G Poje, D Urbančič, C Sturtzel, T Goričan, ... Biomedicine & Pharmacotherapy 177, 116941, 2024 | 2 | 2024 |
| Targeted anticancer pre-vinylsulfone covalent inhibitors of carbonic anhydrase IX A Vaškevičius, D Baronas, J Leitans, A Kvietkauskaitė, A Rukšėnaitė, ... bioRxiv, 2024.05. 20.594908, 2024 | 1 | 2024 |
| Screening, synthesis and biochemical characterization of SARS-CoV-2 protease inhibitors M Bagdonas, K Čerepenkaitė, A Mickevičiūtė, R Kananavičiūtė, ... International journal of molecular sciences 24 (17), 13491, 2023 | 1 | 2023 |
