Grubmüller H - Search Results

1

Infrared spectroscopy reveals metal-independent carbonic anhydrase activity in crotonyl-CoA carboxylase/reductase.

Gomez A, Tinzl M, Stoffel G, Westedt H, Grubmüller H, Erb TJ, Vöhringer-Martinez E, Stripp ST. Gomez A, et al. Among authors: grubmuller h. Chem Sci. 2024 Feb 29;15(13):4960-4968. doi: 10.1039/d3sc04208a. eCollection 2024 Mar 27. Chem Sci. 2024. PMID: 38550681 Free PMC article.

2

Ultrafast phase transitions in metastable water near liquid interfaces.

Link O, Vöhringer-Martinez E, Lugovoj E, Liu Y, Siefermann K, Faubel M, Grubmüller H, Gerber RB, Miller Y, Abel B. Link O, et al. Among authors: grubmuller h. Faraday Discuss. 2009;141:67-79; discussion 81-98. doi: 10.1039/b811659h. Faraday Discuss. 2009. PMID: 19227352

3

Primary steps of pH-dependent insulin aggregation kinetics are governed by conformational flexibility.

Haas J, Vöhringer-Martinez E, Bögehold A, Matthes D, Hensen U, Pelah A, Abel B, Grubmüller H. Haas J, et al. Among authors: grubmuller h. Chembiochem. 2009 Jul 20;10(11):1816-22. doi: 10.1002/cbic.200900266. Chembiochem. 2009. PMID: 19533727

4

Hydrogen bond dynamics of superheated water and methanol by ultrafast IR-pump and EUV-photoelectron probe spectroscopy.

Vöhringer-Martinez E, Link O, Lugovoy E, Siefermann KR, Wiederschein F, Grubmüller H, Abel B. Vöhringer-Martinez E, et al. Among authors: grubmuller h. Phys Chem Chem Phys. 2014 Sep 28;16(36):19365-75. doi: 10.1039/c4cp02063d. Phys Chem Chem Phys. 2014. PMID: 25102451

5

Charge separation and isolation in strong water droplet impacts.

Wiederschein F, Vöhringer-Martinez E, Beinsen A, Postberg F, Schmidt J, Srama R, Stolz F, Grubmüller H, Abel B. Wiederschein F, et al. Among authors: grubmuller h. Phys Chem Chem Phys. 2015 Mar 14;17(10):6858-64. doi: 10.1039/c4cp05618c. Phys Chem Chem Phys. 2015. PMID: 25672904

6

Intersubunit Coupling Enables Fast CO₂-Fixation by Reductive Carboxylases.

DeMirci H, Rao Y, Stoffel GM, Vögeli B, Schell K, Gomez A, Batyuk A, Gati C, Sierra RG, Hunter MS, Dao EH, Ciftci HI, Hayes B, Poitevin F, Li PN, Kaur M, Tono K, Saez DA, Deutsch S, Yoshikuni Y, Grubmüller H, Erb TJ, Vöhringer-Martinez E, Wakatsuki S. DeMirci H, et al. Among authors: grubmuller h. ACS Cent Sci. 2022 Aug 24;8(8):1091-1101. doi: 10.1021/acscentsci.2c00057. Epub 2022 Apr 25. ACS Cent Sci. 2022. PMID: 36032767 Free PMC article.

7

Conformational Dynamics of the Most Efficient Carboxylase Contributes to Efficient CO₂ Fixation.

Gomez A, Erb TJ, Grubmüller H, Vöhringer-Martinez E. Gomez A, et al. Among authors: grubmuller h. J Chem Inf Model. 2023 Dec 25;63(24):7807-7815. doi: 10.1021/acs.jcim.3c01447. Epub 2023 Dec 4. J Chem Inf Model. 2023. PMID: 38049384

8

Accurate Three States Model for Amino Acids with Two Chemically Coupled Titrating Sites in Explicit Solvent Atomistic Constant pH Simulations and pK(a) Calculations.

Dobrev P, Donnini S, Groenhof G, Grubmüller H. Dobrev P, et al. Among authors: grubmuller h. J Chem Theory Comput. 2017 Jan 10;13(1):147-160. doi: 10.1021/acs.jctc.6b00807. Epub 2016 Dec 14. J Chem Theory Comput. 2017. PMID: 27966355

9

Mechanochemical Energy Transduction during the Main Rotary Step in the Synthesis Cycle of F₁-ATPase.

Czub J, Wieczór M, Prokopowicz B, Grubmüller H. Czub J, et al. Among authors: grubmuller h. J Am Chem Soc. 2017 Mar 22;139(11):4025-4034. doi: 10.1021/jacs.6b11708. Epub 2017 Mar 9. J Am Chem Soc. 2017. PMID: 28253614

10

Computing Spatially Resolved Rotational Hydration Entropies from Atomistic Simulations.

Heinz LP, Grubmüller H. Heinz LP, et al. Among authors: grubmuller h. J Chem Theory Comput. 2020 Jan 14;16(1):108-118. doi: 10.1021/acs.jctc.9b00926. Epub 2019 Dec 24. J Chem Theory Comput. 2020. PMID: 31822062 Free article.

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