| Molecular basis for the distinct functions of redox-active and FeS-transfering glutaredoxins D Trnka, AD Engelke, M Gellert, A Moseler, MF Hossain, TT Lindenberg, ... Nature communications 11 (1), 3445, 2020 | 61 | 2020 |
| Inflammageing in the cardiovascular system: mechanisms, emerging targets, and novel therapeutic strategies D Liu, G Richardson, FM Benli, C Park, JV de Souza, AK Bronowska, ... Clinical Science 134 (17), 2243-2262, 2020 | 41 | 2020 |
| Cosolvent Analysis Toolkit (CAT): A robust hotspot identification platform for cosolvent simulations of proteins to expand the druggable proteome F Sabanés Zariquiey, JV de Souza, AK Bronowska Scientific reports 9 (1), 19118, 2019 | 32 | 2019 |
| If you cannot win them, join them: understanding new ways to target STAT3 by small molecules F Sabanés Zariquiey, JV Da Souza, R Estrada-Tejedor, AK Bronowska ACS omega 4 (9), 13913-13921, 2019 | 15 | 2019 |
| An alkynylpyrimidine-based covalent inhibitor that targets a unique cysteine in NF-κB-inducing kinase I Al-Khawaldeh, MJ Al Yasiri, GG Aldred, C Basmadjian, C Bordoni, ... Journal of medicinal chemistry 64 (14), 10001-10018, 2021 | 14 | 2021 |
| New Benchmark in DNA-Based Asymmetric Catalysis: Prevalence of Modified DNA/RNA Hybrid Systems N Duchemin, S Aubert, JV de Souza, L Bethge, S Vonhoff, AK Bronowska, ... JACS Au 2 (8), 1910-1917, 2022 | 13 | 2022 |
| Druggability assessment of mammalian Per–Arnt–Sim [PAS] domains using computational approaches JV de Souza, S Reznikov, R Zhu, AK Bronowska Medchemcomm 10 (7), 1126-1137, 2019 | 13 | 2019 |
| QSAR implementation for HIC retention time prediction of mAbs using fab structure: A comparison between structural representations M Karlberg, JV de Souza, L Fan, A Kizhedath, AK Bronowska, J Glassey International Journal of Molecular Sciences 21 (21), 8037, 2020 | 10 | 2020 |
| Structure, dynamics, and ligand recognition of human-specific CHRFAM7A (Dupα7) nicotinic receptor linked to neuropsychiatric disorders D Liu, JV de Souza, A Ahmad, AK Bronowska International Journal of Molecular Sciences 22 (11), 5466, 2021 | 9 | 2021 |
| Mechanistic investigation of the androgen receptor DNA-binding domain and modulation via direct interactions with DNA abasic sites: understanding the mechanisms involved in … S Xu, MD Kondal, A Ahmad, R Zhu, L Fan, P Zaborniak, KS Madden, ... International Journal of Molecular Sciences 24 (2), 1270, 2023 | 6 | 2023 |
| Development of charge-augmented three-point water model (CAIPi3P) for accurate simulations of intrinsically disordered proteins JV de Souza, FS Zariquiey, AK Bronowska International Journal of Molecular Sciences 21 (17), 6166, 2020 | 6 | 2020 |
| Controlling the heterodimerisation of the phytosulfokine receptor 1 (PSKR1) via island loop modulation JV de Souza, M Kondal, P Zaborniak, R Cairns, AK Bronowska International Journal of Molecular Sciences 22 (4), 1806, 2021 | 4 | 2021 |
| Ligand binding free energy evaluation by Monte Carlo Recursion JV de Souza, VHR Nogueira, AS Nascimento Computational Biology and Chemistry 103, 107830, 2023 | 1 | 2023 |
| Molecular Forces Governing the Biological Function of Per-Arnt-Sim-B (PAS-B) Domains: A Comparative Computational Study JV de Souza, P Zaborniak, S Reznikov, M Kondal, R Zhu, AK Bronowska Biophysica 1 (1), 1-14, 2021 | 1 | 2021 |
| “Druggability” of the PAS domains of human PASK kinase, a therapeutic target for metabolic and liver disorders S Xu, L Fan, P Zaborniak, R Zhu, H Ji, KS Madden, JV de Souza, ... QRB Discovery 2024, 1-21, 2024 | | 2024 |
| Long-Range Entropic Effects on Protein Intrinsically Disordered Regions JV de Souza Cunha, AK Bronowska | | 2019 |
