| Water in protein structure prediction GA Papoian, J Ulander, MP Eastwood, Z Luthey-Schulten, PG Wolynes Proceedings of the National Academy of Sciences 101 (10), 3352-3357, 2004 | 392 | 2004 |
| Role of water mediated interactions in protein− protein recognition landscapes GA Papoian, J Ulander, PG Wolynes Journal of the American Chemical Society 125 (30), 9170-9178, 2003 | 219 | 2003 |
| Permeation across hydrated DPPC lipid bilayers: simulation of the titrable amphiphilic drug valproic acid J Ulander, ADJ Haymet Biophysical journal 85 (6), 3475-3484, 2003 | 137 | 2003 |
| Ligand binding thermodynamics in drug discovery: still a hot tip? S Geschwindner, J Ulander, P Johansson Journal of medicinal chemistry 58 (16), 6321-6335, 2015 | 113 | 2015 |
| High-throughput pKa screening and prediction amenable for ADME profiling H Wan, J Ulander Expert opinion on drug metabolism & toxicology 2 (1), 139-155, 2006 | 110 | 2006 |
| Computational prediction of drug solubility in fasted simulated and aspirated human intestinal fluid JH Fagerberg, E Karlsson, J Ulander, G Hanisch, CAS Bergström Pharmaceutical research 32, 578-589, 2015 | 71 | 2015 |
| Intramolecular hydrogen bond expectations in medicinal chemistry F Giordanetto, C Tyrchan, J Ulander ACS medicinal chemistry letters 8 (2), 139-142, 2017 | 65 | 2017 |
| Role of topology, nonadditivity, and water-mediated interactions in predicting the structures of α/β proteins C Zong, GA Papoian, J Ulander, PG Wolynes Journal of the American Chemical Society 128 (15), 5168-5176, 2006 | 43 | 2006 |
| The decay of pair correlation functions in ionic fluids: a dressed ion theory analysis of Monte Carlo simulations J Ulander, R Kjellander The Journal of Chemical Physics 114 (11), 4893-4904, 2001 | 43 | 2001 |
| Primary and secondary effective charges for electrical double layer systems with asymmetric electrolytes J Ulander, H Greberg, R Kjellander The Journal of Chemical Physics 115 (15), 7144-7160, 2001 | 42 | 2001 |
| Discovery of AZD6642, an inhibitor of 5-lipoxygenase activating protein (FLAP) for the treatment of inflammatory diseases M Lemurell, J Ulander, S Winiwarter, A Dahlen, O Davidsson, ... Journal of Medicinal Chemistry 58 (2), 897-911, 2015 | 39 | 2015 |
| Screening and asymptotic decay of pair distributions in asymmetric electrolytes J Ulander, R Kjellander The Journal of chemical physics 109 (21), 9508-9522, 1998 | 38 | 1998 |
| Pharmacodynamic-pharmacokinetic integration as a guide to medicinal chemistry J Gabrielsson, O Fjellstrom, J Ulander, M Rowley, P H Van Der Graaf Current topics in medicinal chemistry 11 (4), 404-418, 2011 | 34 | 2011 |
| Binding mode and induced fit predictions for prospective computational drug design C Grebner, J Iegre, J Ulander, K Edman, A Hogner, C Tyrchan Journal of Chemical Information and Modeling 56 (4), 774-787, 2016 | 32 | 2016 |
| Discovery and early clinical development of an inhibitor of 5-lipoxygenase activating protein (AZD5718) for treatment of coronary artery disease D Pettersen, J Broddefalk, H Emtenäs, MA Hayes, M Lemurell, ... Journal of Medicinal Chemistry 62 (9), 4312-4324, 2019 | 30 | 2019 |
| Binding thermodynamics discriminates fragments from druglike compounds: a thermodynamic description of fragment-based drug discovery G Williams, GG Ferenczy, J Ulander, GM Keserű Drug Discovery Today 22 (4), 681-689, 2017 | 28 | 2017 |
| A comprehensive company database analysis of biological assay variability C Kramer, G Dahl, C Tyrchan, J Ulander Drug discovery today 21 (8), 1213-1221, 2016 | 26 | 2016 |
| The current impact of water thermodynamics for small-molecule drug discovery S Geschwindner, J Ulander Expert Opinion on Drug Discovery 14 (12), 1221-1225, 2019 | 25 | 2019 |
| Impact of input parameters on the prediction of hepatic plasma clearance using the well-stirred model H Wan, P Bold, LO Larsson, J Ulander, S Peters, B Lofberg, AL Ungell, ... Current drug metabolism 11 (7), 583-594, 2010 | 23 | 2010 |
| Exploring binding mechanisms in nuclear hormone receptors by Monte Carlo and X-ray-derived motions C Grebner, D Lecina, V Gil, J Ulander, P Hansson, A Dellsen, C Tyrchan, ... Biophysical journal 112 (6), 1147-1156, 2017 | 21 | 2017 |
