De novo enzyme design using Rosetta3 F Richter, A Leaver-Fay, SD Khare, S Bjelic, D Baker PloS one 6 (5), e19230, 2011 | 413 | 2011 |
Molecular dynamics simulations of water and biomolecules with a Monte Carlo constant pressure algorithm J Åqvist, P Wennerström, M Nervall, S Bjelic, BO Brandsdal Chemical physics letters 384 (4-6), 288-294, 2004 | 344 | 2004 |
Enantioselective enzymes by computational design and in silico screening HJ Wijma, RJ Floor, S Bjelic, SJ Marrink, D Baker, DB Janssen Angewandte Chemie International Edition 54 (12), 3726-3730, 2015 | 150 | 2015 |
Potent Inhibitors of the Plasmodium falciparum Enzymes Plasmepsin I and II Devoid of Cathepsin D Inhibitory Activity K Ersmark, I Feierberg, S Bjelic, E Hamelink, F Hackett, MJ Blackman, ... Journal of Medicinal Chemistry 47 (1), 110-122, 2004 | 129 | 2004 |
Cold adaptation of enzyme reaction rates S Bjelic, BO Brandsdal, J Åqvist Biochemistry 47 (38), 10049-10057, 2008 | 124 | 2008 |
Computational design of enone-binding proteins with catalytic activity for the Morita–Baylis–Hillman reaction S Bjelic, LG Nivón, N Çelebi-Ölçüm, G Kiss, CF Rosewall, ... ACS chemical biology 8 (4), 749-757, 2013 | 100 | 2013 |
Computational prediction of structure, substrate binding mode, mechanism, and rate for a malaria protease with a novel type of active site S Bjelic, J Åqvist Biochemistry 43 (46), 14521-14528, 2004 | 86 | 2004 |
Catalysis and linear free energy relationships in aspartic proteases S Bjelic, J Åqvist Biochemistry 45 (25), 7709-7723, 2006 | 81 | 2006 |
Computational inhibitor design against malaria plasmepsins S Bjelic, M Nervall, H Gutiérrez-de-Terán, K Ersmark, A Hallberg, J Åqvist Cellular and Molecular Life Sciences 64, 2285-2305, 2007 | 68 | 2007 |
C2-symmetric inhibitors of Plasmodium falciparum plasmepsin II: synthesis and theoretical predictions K Ersmark, I Feierberg, S Bjelic, J Hultén, B Samuelsson, J Åqvist, ... Bioorganic & medicinal chemistry 11 (17), 3723-3733, 2003 | 53 | 2003 |
Exploration of alternate catalytic mechanisms and optimization strategies for retroaldolase design S Bjelic, Y Kipnis, L Wang, Z Pianowski, S Vorobiev, M Su, ... Journal of molecular biology 426 (1), 256-271, 2014 | 43 | 2014 |
Automating human intuition for protein design LG Nivón, S Bjelic, C King, D Baker Proteins: Structure, Function, and Bioinformatics 82 (5), 858-866, 2014 | 35 | 2014 |
Better together: Elements of successful scientific software development in a distributed collaborative community J Koehler Leman, BD Weitzner, PD Renfrew, SM Lewis, R Moretti, ... PLoS Computational Biology 16 (5), e1007507, 2020 | 34 | 2020 |
Small molecule probes to quantify the functional fraction of a specific protein in a cell with minimal folding equilibrium shifts Y Liu, YL Tan, X Zhang, G Bhabha, DC Ekiert, JC Genereux, Y Cho, ... Proceedings of the National Academy of Sciences 111 (12), 4449-4454, 2014 | 27 | 2014 |
The catalytic activity of Abl1 single and compound mutations: Implications for the mechanism of drug resistance mutations in chronic myeloid leukaemia PS Georgoulia, G Todde, S Bjelic, R Friedman Biochimica et Biophysica Acta (BBA)-General Subjects 1863 (4), 732-741, 2019 | 22 | 2019 |
Deciphering the molecular mechanism of FLT3 resistance mutations PS Georgoulia, S Bjelic, R Friedman The FEBS Journal, 2020 | 19 | 2020 |
De Novo-Designed Enzymes as Small-Molecule-Regulated Fluorescence Imaging Tags and Fluorescent Reporters Y Liu, X Zhang, YL Tan, G Bhabha, DC Ekiert, Y Kipnis, S Bjelic, D Baker, ... Journal of the American Chemical Society 136 (38), 13102-13105, 2014 | 19 | 2014 |
Simulations studies of protein kinases that are molecular targets in cancer R Friedman, S Bjelic Israel Journal of Chemistry 60 (7), 667-680, 2020 | 10 | 2020 |
Computational backbone design enables soluble engineering of transferrin receptor apical domain DJ Sjöström, SA Berger, G Oberdorfer, S Bjelic Proteins: Structure, Function, and Bioinformatics 88 (12), 1569-1577, 2020 | 7 | 2020 |
Tuning the binding interface between Machupo virus glycoprotein and human transferrin receptor DJ Sjöström, A Lundgren, SJ Garforth, S Bjelic Proteins: Structure, Function, and Bioinformatics 89 (3), 311-321, 2021 | 6 | 2021 |