Maria M. Reif - Search Results

Year	Number of Results
2006	1
2009	1
2011	2
2012	4
2013	2
2014	3
2015	1
2016	2
2017	2
2018	1
2019	1
2021	0

1

The N-Terminal Segment of the Voltage-Dependent Anion Channel: A Possible Membrane-Bound Intermediate in Pore Unbinding.

Reif MM, Fischer M, Fredriksson K, Hagn F, Zacharias M. Reif MM, et al. J Mol Biol. 2019 Jan 18;431(2):223-243. doi: 10.1016/j.jmb.2018.09.015. Epub 2018 Oct 17. J Mol Biol. 2019. PMID: 30339869

2

Computation of methodology-independent single-ion solvation properties from molecular simulations. IV. Optimized Lennard-Jones interaction parameter sets for the alkali and halide ions in water.

Reif MM, Hünenberger PH. Reif MM, et al. J Chem Phys. 2011 Apr 14;134(14):144104. doi: 10.1063/1.3567022. J Chem Phys. 2011. PMID: 21495739

3

Calculation of Derivative Thermodynamic Hydration and Aqueous Partial Molar Properties of Ions Based on Atomistic Simulations.

Dahlgren B, Reif MM, Hünenberger PH, Hansen N. Dahlgren B, et al. Among authors: reif mm. J Chem Theory Comput. 2012 Oct 9;8(10):3542-64. doi: 10.1021/ct300260q. Epub 2012 Jul 19. J Chem Theory Comput. 2012. PMID: 26593002

4

Effect of Sodium and Chloride Binding on a Lecithin Bilayer. A Molecular Dynamics Study.

Reif MM, Kallies C, Knecht V. Reif MM, et al. Membranes (Basel). 2017 Jan 25;7(1):5. doi: 10.3390/membranes7010005. Membranes (Basel). 2017. PMID: 28125062 Free PMC article.

5

Investigation of ion binding in chlorite dismutases by means of molecular dynamics simulations.

Sündermann A, Reif MM, Hofbauer S, Obinger C, Oostenbrink C. Sündermann A, et al. Among authors: reif mm. Biochemistry. 2014 Jul 29;53(29):4869-79. doi: 10.1021/bi500467h. Epub 2014 Jul 14. Biochemistry. 2014. PMID: 24988286 Free PMC article.

6

Testing of the GROMOS Force-Field Parameter Set 54A8: Structural Properties of Electrolyte Solutions, Lipid Bilayers, and Proteins.

Reif MM, Winger M, Oostenbrink C. Reif MM, et al. J Chem Theory Comput. 2013 Feb 12;9(2):1247-1264. doi: 10.1021/ct300874c. Epub 2013 Jan 2. J Chem Theory Comput. 2013. PMID: 23418406 Free PMC article.

7

Molecular insight into propeptide-protein interactions in cathepsins L and O.

Reif MM, Mach L, Oostenbrink C. Reif MM, et al. Biochemistry. 2012 Oct 30;51(43):8636-53. doi: 10.1021/bi300802a. Epub 2012 Oct 16. Biochemistry. 2012. PMID: 23009386

8

Net charge changes in the calculation of relative ligand-binding free energies via classical atomistic molecular dynamics simulation.

Reif MM, Oostenbrink C. Reif MM, et al. J Comput Chem. 2014 Jan 30;35(3):227-43. doi: 10.1002/jcc.23490. Epub 2013 Nov 19. J Comput Chem. 2014. PMID: 24249099 Free PMC article.

9

Molecular dynamics simulation of configurational ensembles compatible with experimental FRET efficiency data through a restraint on instantaneous FRET efficiencies.

Reif MM, Oostenbrink C. Reif MM, et al. J Comput Chem. 2014 Dec 15;35(32):2319-32. doi: 10.1002/jcc.23756. Epub 2014 Oct 23. J Comput Chem. 2014. PMID: 25338770

10

Computation of methodology-independent single-ion solvation properties from molecular simulations. III. Correction terms for the solvation free energies, enthalpies, entropies, heat capacities, volumes, compressibilities, and expansivities of solvated ions.

Reif MM, Hünenberger PH. Reif MM, et al. J Chem Phys. 2011 Apr 14;134(14):144103. doi: 10.1063/1.3567020. J Chem Phys. 2011. PMID: 21495738

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