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17 (4), pp. 2530 - 2540 (2021)
Optimized Magnesium Force Field Parameters for Biomolecular Simulations with Accurate Solvation, Ion-Binding, and Water-Exchange Properties. Journal of Chemical Theory and Computation 262.
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Editorial: Integrating Timescales From Molecules Up. Frontiers in Chemistry 263.
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7, pp. 524 - 538 (2021)
Structural insights into photosystem II assembly. Nature Plants 264.
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1862 (4), 148379 (2021)
Functional diversity of prokaryotic HdrA(BC) modules: Role in flavin-based electron bifurcation processes and beyond. Biochimica et Biophysica Acta, Bioenergetics 265.
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595 (7), pp. 864 - 880 (2021)
The endolysosomal adaptor PLEKHM1 is a direct target for both mTOR and MAPK pathways. FEBS Letters 266.
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17 (4), e1008790 (2021)
Computational epitope map of SARS-CoV-2 spike protein. PLoS Computational Biology 267.
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Impact of Structural Observables From Simulations to Predict the Effect of Single-Point Mutations in MHC Class II Peptide Binders. Frontiers in Molecular Biosciences 268.
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26 (6), 1664 (2021)
PepFun: Open Source Protocols for Peptide-Related Computational Analysis. Molecules 269.
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7 (11), eabf4213 (2021)
Probing the photointermediates of light-driven sodium ion pump KR2 by DNP-enhanced solid-state NMR. Science Advances 270.
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54, e4 (2021)
Current limitations to high-resolution structure determination by single-particle cryoEM. Quarterly Reviews of Biophysics 271.
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213 (1), 107701 (2021)
Structure of the Yersinia injectisome in intracellular host cell phagosomes revealed by cryo FIB electron tomography. Journal of Structural Biology 272.
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288 (5), pp. 1664 - 1678 (2021)
Structural and spectroscopic characterization of a HdrA‐like subunit from Hyphomicrobium denitrificans. The FEBS Journal 273.
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8 (Pt 2), pp. 186 - 194 (2021)
Devitrification reduces beam-induced movement in cryo-EM. IUCrJ 274.
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12 (7), pp. 1926 - 1931 (2021)
FAM134B-RHD Protein Clustering Drives Spontaneous Budding of Asymmetric Membranes. The Journal of Physical Chemistry Letters 275.
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24 (2), 102021 (2021)
A multi-pronged approach targeting SARS-CoV-2 proteins using ultra-large virtual screening. iScience 276.
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184 (4), pp. 1032 - 1046 (2021)
Cone-shaped HIV-1 capsids are transported through intact nuclear pores. Cell 277.
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12 (1), 1074 (2021)
Asymmetric opening of the homopentameric 5-HT3A serotonin receptor in lipid bilayers. Nature Communications 278.
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120 (3), pp. 568 - 575 (2021)
Temperature Dependence of the Krokinobacter rhodopsin 2 Kinetics. Biophysical Journal (Annual Meeting Abstracts) 279.
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12, pp. 93 - 101 (2021)
Fusion of purple membranes triggered by immobilization on carbon nanomembranes. Beilstein Journal of Nanotechnology 280.
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17 (1), pp. 525 - 537 (2021)
Simulation of FUS Protein Condensates with an Adapted Coarse-Grained Model. Journal of Chemical Theory and Computation