Simonson, T.; Hummer, G.; Roux, B.: Equivalence of M- and P-Summation in Calculations of Ionic Solvation Free Energies. The Journal of Physical Chemistry A 121 (7), pp. 1525 - 1530 (2017)

Schwierz, N.; Frost, C. V.; Geissler, P. L.; Zacharias, M.: From Aβ Filament to Fibril: Molecular Mechanism of Surface-Activated Secondary Nucleation from All-Atom MD Simulations. The Journal of Physical Chemistry B 121 (4), pp. 671 - 682 (2017)

Castaño-Díez, D.; Kudryashev, M.; Stahlberg, H.: Dynamo Catalogue: Geometrical tools and data management for particle picking in subtomogram averaging of cryo-electron tomograms. Journal of Structural Biology 197 (2), pp. 135 - 144 (2017)

Nöll, A.; Christoph, T.; Herbring, V.; Zollmann, T.; Barth, K.; Mehdipour, A. R.; Tomasiak, T. M.; Brüchert, S.; Joseph, B.; Abele, R. et al.; Oliéric, V.; Wang, M.; Diederichs, K.; Hummer, G.; Stroud, R. M.; Pos, K. M.; Tampé, R.: Crystal structure and mechanistic basis of a functional homolog of the antigen transporter TAP. Proceedings of the National Academy of Sciences of the United States of America 114 (4), pp. E438 - E447 (2017)

Konjik, V.; Brünle, S.; Demmer, U.; Vanselow, A.; Sandhoff, R.; Ermler, U.; Mack, M.: The Crystal Structure of RosB: Insights into the Reaction Mechanism of the First Member of a Family of Flavodoxin-like Enzymes. Angewandte Chemie, International Edition in English 56 (4), pp. 1146 - 1151 (2017)

Weidenweber, S.; Schühle, K.; Demmer, U.; Warkentin, E.; Ermler, U.; Heider, J.: Structure of the acetophenone carboxylase core complex: prototype of a new class of ATP-dependent carboxylases/hydrolases. Scientific Reports 7, 39674 (2017)

Blees, A.; Januliene, D.; Hofmann, T.; Koller, N.; Schmidt, C.; Trowitzsch, S.; Moeller, A.; Tampe, R.: Structure of the human MHC-I peptide-loading complex. Nature 551, pp. 525 - 528 (2017)

Christiansen, S. H.; Murphy, R. A.; Juul-Madsen, K.; Fredborg, M.; Hvam, M. L.; Axelgaard, E.; Skovdal, S. M.; Meyer, R. L.; Sørensen, U. B. S.; Möller, A. et al.; Nyengaard, J. R.; Nørskov-Lauritsen, N.; Wang, M.; Gadjeva, M.; Howard, K. A.; Davies, J. C.; Petersen, E.; Vorup-Jensen, T.: The Immunomodulatory Drug Glatiramer Acetate is Also an Effective Antimicrobial Agent that Kills Gram-negative Bacteria. Scientific Reports 7, 15653, pp. 1 - 16 (2017)

Cossio, P.; Rohr, D.; Baruffa, F.; Rampp, M.; Lindenstruth, V.; Hummer, G.: BioEM: GPU-accelerated computing of Bayesian inference of electron microscopy images. Computer Physics Communications 210 (01), pp. 163 - 171 (2017)

Diskowski, M.; Mehdipour, A. R.; Wunnicke, D.; Mills, D. J.; Mikusevic, V.; Bärland, N.; Hoffmann, J.; Morgner, N.; Steinhoff, H.-J.; Hummer, G.: Helical jackknives control the gates of the double-pore K⁺ uptake system KtrABs. eLife, pp. 1 - 21 (2017)

Gold, V. A. M.; Chroscicki, P.; Bragoszewski, P.; Chacinska, A.: Visualization of cytosolic ribosomes on the surface of mitochondria by electron cryo‐tomography. EMBO Reports 18, pp. 1786 - 1800 (2017)

He, C.; Preiss, L.; Wang, B.; Fu, L.; Wen, H.; Zhang, X.; Cui, H.; Meier, T.; Yin, D.: Structural Simplification of Bedaquiline: the Discovery of 3-(4-(N,N-Dimethylaminomethyl)phenyl)quinoline-Derived Antitubercular Lead Compounds. ChemMedChem 12, pp. 106 - 119 (2017)

Januliene, D.; Andersen, J. L.; Nielsen, J. A.; Quistgaard, E. M.; Hansen, M.; Strandbygaard, D.; Moeller, A.; Petersen, C. M.; Madsen, P.; Thirup, S. S.: Acidic Environment Induces Dimerization and Ligand Binding Site Collapse in the Vps10p Domain of Sortilin. Structure 25 (12), pp. 1809 - 1819 (2017)

Januliene, D.; Manavalan, A.; Ovesen, P. L.; Pedersen, K.-M.; Thirup, S.; Nykjær, A.; Moeller, A.: Hidden Twins: SorCS Neuroreceptors Form Stable Dimers. Journal of Molecular Biology (London) 429 (19), pp. 2907 - 2917 (2017)

Kohler, R.; Mooney, R. A.; Mills, D. J.; Landick, R.; Cramer, P.: Architecture of a transcribing-translating expressome. Science 356, pp. 194 - 197 (2017)

López-Alonso, J. P.; Kaminishi, T.; Kikuchi, T.; Hirata, Y.; Iturrioz, I.; Dhimole, N.; Schedlbauer, A.; Hase, Y.; Goto, S.; Kurita, D. et al.; Muto, A.; Zhou, S.; Naoe, C.; Mills, D. J.; Gil-Carton, D.; Takemoto, C.; Himeno, H.; Fucini, P.; Connell, S. R.: RsgA couples the maturation state of the 30S ribosomal decoding center to activation of its GTPase pocket. Nucleic Acids Research 45 (11), pp. 6945 - 6959 (2017)

Mühleip, A. W.; Dewar, C. E.; Schnaufer, A.; Kühlbrandt, W.; Davies, K. M.: In situ structure of trypanosomal ATP synthase dimer reveals a unique arrangement of catalytic subunits. Proceedings of the National Academy of Sciences of the United States of America 114 (5), pp. 992 - 997 (2017)

Nürnberger, P.; Reinhardt, H. M.; Rhinow, D.; Riedel , R.; Werner, S.; Hampp, N. A.: Controlled growth of periodically aligned copper-silicide nanocrystal arrays on silicon directed by laser-induced periodic surface structures (LIPSS). Applied Surface Science 420, pp. 70 - 76 (2017)

Payer, S. E.; Marshall, S. A.; Bärland, N.; Sheng, X.; Reiter, T.; Dordic, A.; Steinkellner, G.; Wuensch, C.; Kaltwasser, S.; Fisher, K. et al.; Rigby, S. E. J.; Macheroux, P.; Vonck, J.; Gruber, K.; Faber, K.; Himo, F.; Leys, D.; Pavkov-Keller, T.; Glueck, S. M.: Regioselective para-Carboxylation of Catechols with a Prenylated Flavin Dependent Decarboxylase. Angewandte Chemie, International Edition in English 56 (44), pp. 13893 - 13897 (2017)

Retel, J. S.; Nieuwkoop, A. J.; Hiller, M.; Higman, V. A.; Barbet-Massin, E.; Stanek, J.; Andreas, L. B.; Franks, W. T.; van Rossum, B.-J.; Vinothkumar, K. R. et al.; Handel, L.; de Palma, G. G.; Bardiaux, B.; Pintacuda, G.; Emsley, L.; Kühlbrandt, W.; Oschkinat, H.: Structure of outer membrane protein G in lipid bilayers. Nature Communications 8, 2073, p. 1 (2017)