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Items: 1 to 20 of 36

1.

Adsorption and Diffusion of Cisplatin Molecules in Nanoporous Materials: A Molecular Dynamics Study.

Nejad MA, Urbassek HM.

Biomolecules. 2019 May 27;9(5). pii: E204. doi: 10.3390/biom9050204.

2.

Shear-Transformation Zone Activation during Loading and Unloading in Nanoindentation of Metallic Glasses.

Avila KE, Küchemann S, Alabd Alhafez I, Urbassek HM.

Materials (Basel). 2019 May 7;12(9). pii: E1477. doi: 10.3390/ma12091477.

3.

Effect of Alloying Elements on the α-γ Phase Transformation in Iron.

Meiser J, Urbassek HM.

Materials (Basel). 2019 Apr 25;12(8). pii: E1355. doi: 10.3390/ma12081355.

4.

Bouncing window for colliding nanoparticles: Role of dislocation generation.

Nietiadi ML, Millán EN, Bringa EM, Urbassek HM.

Phys Rev E. 2019 Mar;99(3-1):032904. doi: 10.1103/PhysRevE.99.032904.

PMID:
30999515
5.

Diffusion of cisplatin molecules in silica nanopores: Molecular dynamics study of a targeted drug delivery system.

Nejad MA, Urbassek HM.

J Mol Graph Model. 2019 Jan;86:228-234. doi: 10.1016/j.jmgm.2018.10.021. Epub 2018 Oct 25.

PMID:
30390543
6.

Alcohol reduces muscle fatigue through atomistic interactions with nicotinic receptors.

Noori HR, Mücksch C, Vengeliene V, Schönig K, Takahashi TT, Mukhtasimova N, Bagher Oskouei M, Mosqueira M, Bartsch D, Fink R, Urbassek HM, Spanagel R, Sine SM.

Commun Biol. 2018 Oct 3;1:159. doi: 10.1038/s42003-018-0157-9. eCollection 2018.

7.

Insulin adsorption on functionalized silica surfaces: an accelerated molecular dynamics study.

Nejad MA, Urbassek HM.

J Mol Model. 2018 Mar 9;24(4):89. doi: 10.1007/s00894-018-3610-2.

PMID:
29524008
8.

Correction to "Contact Angle of Sessile Drops in Lennard-Jones Systems".

Heier M, Becker S, Urbassek HM, Horsch M, Hasse H.

Langmuir. 2018 Mar 13;34(10):3374. doi: 10.1021/acs.langmuir.8b00609. Epub 2018 Mar 1. No abstract available.

PMID:
29494153
9.

Influence of Elastic Stiffness and Surface Adhesion on Bouncing of Nanoparticles.

Umstätter P, Urbassek HM.

Nanoscale Res Lett. 2017 Dec 22;12(1):637. doi: 10.1186/s11671-017-2410-4.

10.

The bouncing threshold in silica nanograin collisions.

Nietiadi ML, Umstätter P, Tjong T, Rosandi Y, Millán EN, Bringa EM, Urbassek HM.

Phys Chem Chem Phys. 2017 Jun 28;19(25):16555-16562. doi: 10.1039/c7cp02106b.

PMID:
28612852
11.

Accelerated Molecular Dynamics Study of the Effects of Surface Hydrophilicity on Protein Adsorption.

Mücksch C, Urbassek HM.

Langmuir. 2016 Sep 13;32(36):9156-62. doi: 10.1021/acs.langmuir.6b02229. Epub 2016 Aug 29.

PMID:
27533302
12.

Forced Desorption of Bovine Serum Albumin and Lysozyme from Graphite: Insights from Molecular Dynamics Simulation.

Mücksch C, Urbassek HM.

J Phys Chem B. 2016 Aug 18;120(32):7889-95. doi: 10.1021/acs.jpcb.6b05234. Epub 2016 Aug 9.

PMID:
27421144
13.

Nucleation of plasticity in nanoparticle collisions.

Millán EN, Tramontina DR, Urbassek HM, Bringa EM.

Phys Rev E. 2016 Jun;93(6):063004. doi: 10.1103/PhysRevE.93.063004. Epub 2016 Jun 27.

PMID:
27415351
14.

Accelerating Steered Molecular Dynamics: Toward Smaller Velocities in Forced Unfolding Simulations.

Mücksch C, Urbassek HM.

J Chem Theory Comput. 2016 Mar 8;12(3):1380-4. doi: 10.1021/acs.jctc.5b01024. Epub 2016 Feb 19.

PMID:
26859233
15.

Nanoindentation of hcp metals: a comparative simulation study of the evolution of dislocation networks.

Alhafez IA, Ruestes CJ, Gao Y, Urbassek HM.

Nanotechnology. 2016 Jan 29;27(4):045706. doi: 10.1088/0957-4484/27/4/045706. Epub 2015 Dec 14.

PMID:
26655887
16.

The elastic-plastic transition in nanoparticle collisions.

Millán EN, Tramontina DR, Urbassek HM, Bringa EM.

Phys Chem Chem Phys. 2016 Feb 7;18(5):3423-9. doi: 10.1039/c5cp05150a.

PMID:
26456630
17.

Collision-spike Sputtering of Au Nanoparticles.

Sandoval L, Urbassek HM.

Nanoscale Res Lett. 2015 Dec;10(1):1009. doi: 10.1186/s11671-015-1009-x. Epub 2015 Aug 6.

18.

Compaction of highly porous granular matter by impacts on a hard wall.

Ringl C, Gunkelmann N, Bringa EM, Urbassek HM.

Phys Rev E Stat Nonlin Soft Matter Phys. 2015 Apr;91(4):042205. Epub 2015 Apr 30.

PMID:
25974482
19.

A structural feature of the non-peptide ligand interactions with mice mu-opioid receptors.

Noori HR, Mucksch C, Urbassek HM.

Curr Comput Aided Drug Des. 2014;10(4):354-60.

PMID:
25360566
20.

Contact angle of sessile drops in Lennard-Jones systems.

Becker S, Urbassek HM, Horsch M, Hasse H.

Langmuir. 2014 Nov 18;30(45):13606-14. doi: 10.1021/la503974z. Epub 2014 Nov 5. Erratum in: Langmuir. 2018 Mar 13;34(10):3374.

PMID:
25329011

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