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Showing 13 to 24 of 206 entries
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GVVPT2 multireference perturbation theory description of diatomic scandium, chromium, and manganese.

The journal of physical chemistry. A

Tamukong PK, Theis D, Khait YG, Hoffmann MR.
PMID: 22512304
J Phys Chem A. 2012 May 10;116(18):4590-601. doi: 10.1021/jp300401u. Epub 2012 May 01.

With relatively simple model spaces derived from valence bond models, a straightforward zero-order Hamiltonian, and the use of moderate-sized Dunning-type correlation consistent basis sets (cc-pVTZ, aug-cc-pVTZ, and cc-pVQZ), the second order generalized Van Vleck perturbation theory (GVVPT2) method is...

Ground states of a ternary fcc lattice model with nearest- and next-nearest-neighbor interactions.

Physical review. B, Condensed matter

Avis D, Ceder G, Fukuda K, Garbulsky GD.
PMID: 10009249
Phys Rev B Condens Matter. 1994 Jan 01;49(1):1-7. doi: 10.1103/physrevb.49.1.

No abstract available.

Thermal Cross Linking of Novel Azide Modified Polymers of Intrinsic Microporosity-Effect of Distribution and the Gas Separation Performance.

Polymers

Neumann S, Bengtson G, Meis D, Filiz V.
PMID: 31357493
Polymers (Basel). 2019 Jul 26;11(8). doi: 10.3390/polym11081241.

The synthesis of polymers of intrinsic microporosity (PIM) modified with azide groups, the cross linkage by nitrene reaction and their performance as gas separation membranes are reported. The azide modification of the spirobisindane units in the polymer backbone was...

On Zebrafish Disease Models and Matters of the Heart.

Biomedicines

Giardoglou P, Beis D.
PMID: 30823496
Biomedicines. 2019 Feb 28;7(1). doi: 10.3390/biomedicines7010015.

Coronary artery disease (CAD) is the leading form of cardiovascular disease (CVD), which is the primary cause of mortality worldwide. It is a complex disease with genetic and environmental risk factor contributions. Reports in human and mammalian models elucidate...

Elastography in Distinguishing Benign from Malignant Thyroid Nodules.

Journal of clinical imaging science

Colakoglu B, Yildirim D, Alis D, Ucar G, Samanci C, Ustabasioglu FE, Bakir A, Ulusoy OL.
PMID: 28123841
J Clin Imaging Sci. 2016 Dec 29;6:51. doi: 10.4103/2156-7514.197074. eCollection 2016.

AIM: The aim of this study is to test the diagnostic success of strain elastography in distinguishing benign from malignant thyroid nodules.MATERIALS AND METHODS: The size, echogenicity, and halo integrity of 293 thyroid nodules and the presence of microcalcification...

Evaluation of carotid intima-media thickness with vascular endothelial growth factor and malondialdehyde levels in patients with sarcoidosis.

Diagnostic and interventional imaging

Samanci NS, Poturoglu S, Samanci C, Alis D, Emre HO, Koldas M, Ozcelik HK, Durmus T, Kantarci F, Ozturk S.
PMID: 28506681
Diagn Interv Imaging. 2017 Jul - Aug;98(7):557-561. doi: 10.1016/j.diii.2017.04.004. Epub 2017 May 12.

PURPOSE: To assess the impact of sarcoidosis on endothelial function by measuring carotid intima-media thickness (CIMT) and serum levels of malondialdehyde and vascular endothelial growth factor (VEGF).MATERIALS AND METHODS: We prospectively analyzed 41 patients with sarcoidosis (9 men, 32...

Testicular hemangioma mimicking a malignant neoplasm.

Radiology case reports

Ben Abda R, Bess D, Nieves-Robbins N.
PMID: 27257466
Radiol Case Rep. 2016 Feb 12;11(2):121-3. doi: 10.1016/j.radcr.2015.12.005. eCollection 2016 Jun.

A 34-year-old man who presented with right scrotal pain, and who on subsequent ultrasound examination, was found to have an intratesticular hypoechoic mass. Based on the ultrasound appearance of this mass, a malignant germ cell tumor was thought to...

Three in a Box: Understanding Cardiomyocyte, Fibroblast, and Innate Immune Cell Interactions to Orchestrate Cardiac Repair Processes.

Frontiers in cardiovascular medicine

Psarras S, Beis D, Nikouli S, Tsikitis M, Capetanaki Y.
PMID: 31001541
Front Cardiovasc Med. 2019 Apr 02;6:32. doi: 10.3389/fcvm.2019.00032. eCollection 2019.

Following an insult by both intrinsic and extrinsic pathways, complex cellular, and molecular interactions determine a successful recovery or inadequate repair of damaged tissue. The efficiency of this process is particularly important in the heart, an organ characterized by...

Correlation Energy Extrapolation by Many-Body Expansion.

The journal of physical chemistry. A

Boschen JS, Theis D, Ruedenberg K, Windus TL.
PMID: 28068093
J Phys Chem A. 2017 Feb 02;121(4):836-844. doi: 10.1021/acs.jpca.6b10953. Epub 2017 Jan 24.

Accounting for electron correlation is required for high accuracy calculations of molecular energies. The full configuration interaction (CI) approach can fully capture the electron correlation within a given basis, but it does so at a computational expense that is...

A Frequency-Based Approach for the Detection and Classification of Structural Changes Using .

Sensors (Basel, Switzerland)

Agis D, Pozo F.
PMID: 31766460
Sensors (Basel). 2019 Nov 21;19(23). doi: 10.3390/s19235097.

This work presents a structural health monitoring (SHM) approach for the detection and classification of structural changes. The proposed strategy is based on

Analysis of subthreshold antiproton production in p-nucleus and nucleus-nucleus collisions in the relativistic Boltzmann-Uehling-Uhlenbeck approach.

Physical review. C, Nuclear physics

Cassing W, Maruyama T, Mosel U, Teis S.
PMID: 9969672
Phys Rev C Nucl Phys. 1994 Jul;50(1):388-405. doi: 10.1103/physrevc.50.388.

No abstract available.

Populations of extended-spectrum β-lactamase-producing Escherichia coli and Klebsiella pneumoniae are different in human-polluted environment and food items: a multicentre European study.

Clinical microbiology and infection : the official publication of the European Society of Clinical Microbiology and Infectious Diseases

Martak D, Guther J, Verschuuren TD, Valot B, Conzelmann N, Bunk S, Riccio ME, Salamanca E, Meunier A, Henriot CP, Brossier CP, Bertrand X, Cooper BS, Harbarth S, Tacconelli E, Fluit AC, Rodriguez-Baño J, Kluytmans JAJW, Peter S, Hocquet D.
PMID: 34325070
Clin Microbiol Infect. 2021 Jul 26; doi: 10.1016/j.cmi.2021.07.022. Epub 2021 Jul 26.

OBJECTIVES: To assess the extent to which food items are a source of extended-spectrum β-lactamase (ESBL) -producing Escherichia coli (ESBL-Ec) and ESBL-producing Klebsiella pneumoniae (ESBL-Kp) for humans in five European cities.METHODS: We sampled 122 human polluted (hp)-environments (sewers and...

Showing 13 to 24 of 206 entries