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Showing 1 to 12 of 326 entries
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Visual Analysis of Inclusion Dynamics in Two-Phase Flow.

IEEE transactions on visualization and computer graphics

Karch GK, Beck F, Ertl M, Meister C, Schulte K, Weigand B, Ertl T, Sadlo F.
PMID: 28422684
IEEE Trans Vis Comput Graph. 2018 May;24(5):1841-1855. doi: 10.1109/TVCG.2017.2692781. Epub 2017 Apr 12.

In single-phase flow visualization, research focuses on the analysis of vector field properties. In two-phase flow, in contrast, analysis of the phase components is typically of major interest. So far, visualization research of two-phase flow concentrated on proper interface...

Hierarchical analysis of the degradation of fibre-reinforced polymers under the presence of void imperfections.

Philosophical transactions. Series A, Mathematical, physical, and engineering sciences

Liebig WV, Schulte K, Fiedler B.
PMID: 27242296
Philos Trans A Math Phys Eng Sci. 2016 Jul 13;374(2071):20150279. doi: 10.1098/rsta.2015.0279.

The subject of this work is the investigation of the influence of voids on the mechanical properties of fibre-reinforced polymers (FRPs) under compression loading. To specify the damage accumulation of FRPs in the presence of voids, the complex three-dimensional...

Nutrition and Hepatocellular Cancer.

Gastrointestinal tumors

Schütte K, Schulz C, Malfertheiner P.
PMID: 27403413
Gastrointest Tumors. 2016 May;2(4):188-94. doi: 10.1159/000441822. Epub 2015 Nov 18.

BACKGROUND: Hepatocellular carcinoma (HCC) significantly contributes to the global burden of cancer. Liver cancer is the third most frequent cause of cancer-related death with HCC representing more than 90% of primary liver cancers. The majority of patients are not...

Adaptive Resolution Simulation (AdResS): A Smooth Thermodynamic and Structural Transition from Atomistic to Coarse Grained Resolution and Vice Versa in a Grand Canonical Fashion.

Journal of chemical theory and computation

Wang H, Schütte C, Delle Site L.
PMID: 26592127
J Chem Theory Comput. 2012 Aug 14;8(8):2878-87. doi: 10.1021/ct3003354. Epub 2012 Jul 24.

The AdResS method in molecular dynamics (MD) allows, in a grand canonical (GC) fashion, to change on-the-fly the number of degrees of freedom of a system, allowing to pass from atomistic (AT) to coarse-grained (CG) resolution and vice versa...

Frontofacionasal Dysplasia in a Newborn with a De Novo Duplication of 7p15.2-p15.1.

AJP reports

Mansour T, Wei S, Netzloff M, Mohamed T, Schutte B, Omar SA.
PMID: 26495166
AJP Rep. 2015 Oct;5(2):e111-e1115. doi: 10.1055/s-0035-1549299. Epub 2015 May 15.

We report a new case of frontofacionasal dysplasia or dysostosis (FFND) with a 1.5 Mb duplication in the region of 7p15.2-p15.1, and provide a review of the literature to understand the underlying pathogenesis better.

Chemical potential of liquids and mixtures via adaptive resolution simulation.

The Journal of chemical physics

Agarwal A, Wang H, Schütte C, Delle Site L.
PMID: 25053296
J Chem Phys. 2014 Jul 21;141(3):034102. doi: 10.1063/1.4886807.

We employ the adaptive resolution approach AdResS, in its recently developed Grand Canonical-like version (GC-AdResS) [H. Wang, C. Hartmann, C. Schütte, and L. Delle Site, Phys. Rev. X 3, 011018 (2013)], to calculate the excess chemical potential, μ(ex), of...

Descriptive diagnostic assessment of depression Categorical diagnosis, dimensional assessment, and instruments.

Acta neuropsychiatrica

Schotte CK, Maes M.
PMID: 26983762
Acta Neuropsychiatr. 2001 Mar;13(1):2-12. doi: 10.1017/S0924270800035298.

The descriptive diagnostics constitute the first step, the base and the prerequisite for the psychodiagnostic process and the treatment of depression. Within the descriptive diagnostics, two approaches are distinguished, namely (1) the differentiation between dimensional and categorical levels of...

Iron phthalocyanine on Cu(111): Coverage-dependent assembly and symmetry breaking, temperature-induced homocoupling, and modification of the adsorbate-surface interaction by annealing.

The Journal of chemical physics

Snezhkova O, Bischoff F, He Y, Wiengarten A, Chaudhary S, Johansson N, Schulte K, Knudsen J, Barth JV, Seufert K, Auwärter W, Schnadt J.
PMID: 26957171
J Chem Phys. 2016 Mar 07;144(9):094702. doi: 10.1063/1.4942121.

We have examined the geometric and electronic structures of iron phthalocyanine assemblies on a Cu(111) surface at different sub- to mono-layer coverages and the changes induced by thermal annealing at temperatures between 250 and 320 °C by scanning tunneling...

Nanomechanics of individual aerographite tetrapods.

Nature communications

Meija R, Signetti S, Schuchardt A, Meurisch K, Smazna D, Mecklenburg M, Schulte K, Erts D, Lupan O, Fiedler B, Mishra YK, Adelung R, Pugno NM.
PMID: 28401930
Nat Commun. 2017 Apr 12;8:14982. doi: 10.1038/ncomms14982.

Carbon-based three-dimensional aerographite networks, built from interconnected hollow tubular tetrapods of multilayer graphene, are ultra-lightweight materials recently discovered and ideal for advanced multifunctional applications. In order to predict the bulk mechanical behaviour of networks it is very important to...

Utilizing weak pump depletion to stabilize squeezed vacuum states.

Optics express

Denker T, Schütte D, Wimmer MH, Wheatley TA, Huntington EH, Heurs M.
PMID: 26191663
Opt Express. 2015 Jun 29;23(13):16517-28. doi: 10.1364/OE.23.016517.

We propose and demonstrate a pump-phase locking technique that makes use of weak pump depletion (WPD) - an unavoidable effect that is usually neglected - in a sub-threshold optical parametric oscillator (OPO). We show that the phase difference between...

Correction to: Age Neutrality of Categorically and Dimensionally Measured DSM-5 Section II Personality Disorder Symptoms.

Journal of personality assessment

Debast I, Rossi G, van Alphen SP, Pauwels E, Claes L, Dierckx E, Peuskens H, Santens E, Schotte CK.
PMID: 26186505
J Pers Assess. 2015;97(6):661. doi: 10.1080/00223891.2015.1059662. Epub 2015 Jul 17.

No abstract available.

EMMA: A Software Package for Markov Model Building and Analysis.

Journal of chemical theory and computation

Senne M, Trendelkamp-Schroer B, Mey AS, Schütte C, Noé F.
PMID: 26588955
J Chem Theory Comput. 2012 Jul 10;8(7):2223-38. doi: 10.1021/ct300274u. Epub 2012 Jun 18.

The study of folding and conformational changes of macromolecules by molecular dynamics simulations often requires the generation of large amounts of simulation data that are difficult to analyze. Markov (state) models (MSMs) address this challenge by providing a systematic...

Showing 1 to 12 of 326 entries