| A practical guide to large-scale docking BJ Bender, S Gahbauer, A Luttens, J Lyu, CM Webb, RM Stein, EA Fink, ... Nature protocols 16 (10), 4799-4832, 2021 | 276 | 2021 |
| Ultralarge virtual screening identifies SARS-CoV-2 main protease inhibitors with broad-spectrum activity against coronaviruses A Luttens, H Gullberg, E Abdurakhmanov, DD Vo, D Akaberi, VO Talibov, ... Journal of the American Chemical Society 144 (7), 2905-2920, 2022 | 151 | 2022 |
| Importance of binding site hydration and flexibility revealed when optimizing a macrocyclic inhibitor of the Keap1–Nrf2 protein–protein interaction F Begnini, S Geschwindner, P Johansson, L Wissler, RJ Lewis, ... Journal of medicinal chemistry 65 (4), 3473-3517, 2022 | 18 | 2022 |
| Docking finds GPCR ligands in dark chemical matter F Ballante, A Rudling, A Zeifman, A Luttens, DD Vo, JJ Irwin, J Kihlberg, ... Journal of Medicinal Chemistry 63 (2), 613-620, 2019 | 17 | 2019 |
| Design of Drug Efficacy Guided by Free Energy Simulations of the β2‐Adrenoceptor N Panel, DD Vo, NA Kahlous, H Hübner, S Tiedt, P Matricon, J Pacalon, ... Angewandte Chemie International Edition 62 (22), e202218959, 2023 | 9 | 2023 |
| Structure-based virtual screening discovers potent and selective adenosine A1 receptor antagonists P Matricon, ATN Nguyen, DD Vo, JA Baltos, M Jaiteh, A Luttens, ... European Journal of Medicinal Chemistry 257, 115419, 2023 | 6 | 2023 |
| Rapid Traversal of Ultralarge Chemical Space using Machine Learning Guided Docking Screens A Luttens, IC de Vaca, L Sparring, U Norinder, J Carlsson | 2 | 2023 |
| Publisher Correction: A practical guide to large-scale docking BJ Bender, S Gahbauer, A Luttens, J Lyu, CM Webb, RM Stein, EA Fink, ... Nature protocols 17 (1), 177, 2022 | 2 | 2022 |
| Discovery of Chemical Probes through Structure-based Virtual Screening of Vast Compound Databases A Luttens Acta Universitatis Upsaliensis, 2023 | | 2023 |
| Virtual Fragment Screening for DNA Repair Inhibitors in Vast Chemical Space A Luttens, D Vo, E Scaletti, E Wiita, I Almlöf, O Wallner, J Davies, ... | | 2023 |
| Structure-based optimization of a macrocyclic inhibitor of the Keap1-Nrf2 protein-protein interaction F Begnini, S Geschwindner, P Johansson, L Wissler, R Lewis, E Danelius, ... | | 2021 |
| Docking finds GPCR ligands in dark chemical matter A Rudling, D Vo, J Irwin, J Brea, F Ballante, J Kihlberg, M Loza, ... American Chemical Society SciMeetings 1 (2), 2020 | | 2020 |
Jens CarlssonProfessor, Uppsala UniversityVerified email at icm.uu.se
