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Zeitschriftenartikel (238)
1.
Zeitschriftenartikel
Reference Data Set for Circular Dichroism Spectroscopy Comprised of Validated Intrinsically Disordered Protein Models. Applied Spectroscopy (2024)
2.
Zeitschriftenartikel
15, S. 4960 - 4968 (2024)
Infrared spectroscopy reveals metal-independent carbonic anhydrase activity in crotonyl-CoA carboxylase/reductase. Chemical Science 3.
Zeitschriftenartikel
63 (24), S. 7807 - 7815 (2023)
Conformational Dynamics of the Most Efficient Carboxylase Contributes to Efficient CO2 Fixation. Journal of Chemical Information and Modeling 4.
Zeitschriftenartikel
19 (22), S. 8013 - 8019 (2023)
Why Solvent Response Contributions to Solvation Free Energies Are Compatible with Ben-Naim’s Theorem. Journal of Chemical Theory and Computation 5.
Zeitschriftenartikel
19 (16), S. 5516 - 5524 (2023)
Uncertainties in Markov State Models of Small Proteins. Journal of Chemical Theory and Computation 6.
Zeitschriftenartikel
30, S. 1380 - 1392 (2023)
Structural conservation of antibiotic interaction with ribosomes. Nature Structural & Molecular Biology 7.
Zeitschriftenartikel
52, S. 361 - 390 (2023)
Simulation of Complex Biomolecular Systems: The Ribosome Challenge. Annual Review of Biophysics 8.
Zeitschriftenartikel
30, S. 512 - 520 (2023)
Discrimination between cyclic nucleotides in a cyclic nucleotide-gated ion channel. Nature Structural and Molecular Biology 9.
Zeitschriftenartikel
120 (8), e2215650120 (2023)
Molecular mechanism and energetics of coupling between substrate binding and product release in the F1-ATPase catalytic cycle. Proceedings of the National Academy of Sciences of the United States of America 10.
Zeitschriftenartikel
20, S. 2587 - 2599 (2022)
Nanomechanics combined with HDX reveals allosteric drug binding sites of CFTR NBD1. Computational and Structural Biotechnology Journal 11.
Zeitschriftenartikel
8 (8), S. 1091 - 1101 (2022)
Intersubunit Coupling Enables Fast CO2-Fixation by Reductive Carboxylases. ACS Central Science 12.
Zeitschriftenartikel
105, 044404 (2022)
Estimating ruggedness of free-energy landscapes of small globular proteins from principal component analysis of molecular dynamics trajectories. Physical Review E 13.
Zeitschriftenartikel
62 (7), S. 1691 - 1711 (2022)
GROMACS in the cloud: A global supercomputer to speed up alchemical drug design. Journal of Chemical Information and Modeling 14.
Zeitschriftenartikel
13, 1709 (2022)
Effects of cryo-EM cooling on structural ensembles. Nature Communications 15.
Zeitschriftenartikel
119 (12), e2115516119 (2022)
Bending-torsional elasticity and energetics of the plus-end microtubule tip. Proceedings of the National Academy of Sciences of the United States of America 16.
Zeitschriftenartikel
50 (4), S. 2258 - 2269 (2022)
Folding of VemP into translation-arresting secondary structure is driven by the ribosome exit tunnel. Nucleic Acids Research 17.
Zeitschriftenartikel
104 (5), 054133 (2021)
Small-sample limit of the Bennett acceptance ratio method and the variationally derived intermediates. Physical Review E 18.
Zeitschriftenartikel
266, 108022 (2021)
Implementation of a Bayesian secondary structure estimation method for the SESCA circular dichroism analysis package. Computer Physics Communications 19.
Zeitschriftenartikel
17 (9), S. 5766 - 5776 (2021)
Time-lagged independent component analysis of random walks and protein dynamics. Journal of Chemical Theory and Computation 20.
Zeitschriftenartikel
120, S. 3470 - 3482 (2021)
Spatially resolved free-energy contributions of native fold and molten-globule-like Crambin. Biophysical Journal