Johan Åqvist

Affiliations: 
Uppsala University, Uppsala, Uppsala län, Sweden 
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"Johan Åqvist"
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Jespers W, Verdon G, Azuaje J, et al. (2020) X-Ray Crystallography and Free Energy Calculations Reveal the Binding Mechanism of A Adenosine Receptor Antagonists. Angewandte Chemie (International Ed. in English)
Kumar A, Åqvist J, Satpati P. (2019) Principles of tRNA Selection by Alanyl-tRNA Synthetase Based on the Critical G3·U70 Base Pair. Acs Omega. 4: 15539-15548
Jespers W, Isaksen GV, Andberg TAH, et al. (2019) QresFEP: an automated protocol for the free energy calculation of protein mutations in Q. Journal of Chemical Theory and Computation
Jespers W, Esguerra M, Åqvist J, et al. (2019) QligFEP: an automated workflow for small molecule free energy calculations in Q. Journal of Cheminformatics. 11: 26
Lind C, Esguerra M, Jespers W, et al. (2019) Free energy calculations of RNA interactions. Methods (San Diego, Calif.)
Ge X, Mandava CS, Lind C, et al. (2018) Complementary charge-based interaction between the ribosomal-stalk protein L7/12 and IF2 is the key to rapid subunit association. Proceedings of the National Academy of Sciences of the United States of America
Vasile S, Esguerra M, Jespers W, et al. (2018) Characterization of Ligand Binding to GPCRs Through Computational Methods. Methods in Molecular Biology (Clifton, N.J.). 1705: 23-44
Lind C, Oliveira A, Åqvist J. (2017) Origin of the omnipotence of eukaryotic release factor 1. Nature Communications. 8: 1425
Jespers W, Oliveira A, Prieto-Díaz R, et al. (2017) Structure-Based Design of Potent and Selective Ligands at the Four Adenosine Receptors. Molecules (Basel, Switzerland). 22
Azuaje J, Jespers W, Yaziji V, et al. (2017) Effect of Nitrogen Atom Substitution in A Adenosine Receptor Binding: N-(4,6-Diarylpyridin-2-yl)acetamides as Potent and Selective Antagonists. Journal of Medicinal Chemistry. 60: 7502-7511
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