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Structure of a fully assembled tumor-specific T cell receptor ligated by pMHC.
Sušac L, Vuong MT, Thomas C, von Bülow S, O'Brien-Ball C, Santos AM, Fernandes RA, Hummer G, Tampé R, Davis SJ. Sušac L, et al. Among authors: von bulow s. Cell. 2022 Aug 18;185(17):3201-3213.e19. doi: 10.1016/j.cell.2022.07.010. Cell. 2022. PMID: 35985289 Free PMC article.
Bidirectional Control of Autophagy by BECN1 BARA Domain Dynamics.
Chang C, Young LN, Morris KL, von Bülow S, Schöneberg J, Yamamoto-Imoto H, Oe Y, Yamamoto K, Nakamura S, Stjepanovic G, Hummer G, Yoshimori T, Hurley JH. Chang C, et al. Among authors: von bulow s. Mol Cell. 2019 Jan 17;73(2):339-353.e6. doi: 10.1016/j.molcel.2018.10.035. Epub 2018 Dec 20. Mol Cell. 2019. PMID: 30581147 Free PMC article.
Optimal estimates of self-diffusion coefficients from molecular dynamics simulations.
Bullerjahn JT, von Bülow S, Hummer G. Bullerjahn JT, et al. Among authors: von bulow s. J Chem Phys. 2020 Jul 14;153(2):024116. doi: 10.1063/5.0008312. J Chem Phys. 2020. PMID: 32668929
As an illustration, we apply the formalism to molecular dynamics simulation data of pure TIP4P-D water and a single ubiquitin protein. In another paper [S. von Bulow, J. T. Bullerjahn, and G. Hummer, J. Chem. Phys. 153, 021101 (2020)], we demonstrate its abil …
As an illustration, we apply the formalism to molecular dynamics simulation data of pure TIP4P-D water and a single ubiquitin protein. In an …
Systematic errors in diffusion coefficients from long-time molecular dynamics simulations at constant pressure.
von Bülow S, Bullerjahn JT, Hummer G. von Bülow S, et al. J Chem Phys. 2020 Jul 14;153(2):021101. doi: 10.1063/5.0008316. J Chem Phys. 2020. PMID: 32668935
At each time step, we add the minimal displacement vector according to periodic boundary conditions for the instantaneous box geometry. Here and in another paper [J. T. Bullerjahn, S. von Bulow, and G. Hummer, J. Chem. Phys. 153, 024116 (2020)], we apply the …
At each time step, we add the minimal displacement vector according to periodic boundary conditions for the instantaneous box geometry. Here …
Compaction of RNA Duplexes in the Cell*.
Collauto A, von Bülow S, Gophane DB, Saha S, Stelzl LS, Hummer G, Sigurdsson ST, Prisner TF. Collauto A, et al. Among authors: von bulow s. Angew Chem Int Ed Engl. 2020 Dec 14;59(51):23025-23029. doi: 10.1002/anie.202009800. Epub 2020 Oct 13. Angew Chem Int Ed Engl. 2020. PMID: 32804430 Free PMC article.
In situ structural analysis of SARS-CoV-2 spike reveals flexibility mediated by three hinges.
Turoňová B, Sikora M, Schürmann C, Hagen WJH, Welsch S, Blanc FEC, von Bülow S, Gecht M, Bagola K, Hörner C, van Zandbergen G, Landry J, de Azevedo NTD, Mosalaganti S, Schwarz A, Covino R, Mühlebach MD, Hummer G, Krijnse Locker J, Beck M. Turoňová B, et al. Among authors: von bulow s. Science. 2020 Oct 9;370(6513):203-208. doi: 10.1126/science.abd5223. Epub 2020 Aug 18. Science. 2020. PMID: 32817270 Free PMC article.
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