Materials Literature
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BACKGROUND: Treatment standard for patients with rectal cancer depends on the initial staging and includes surgical resection, radiotherapy as well as chemotherapy. For stage II and III tumors, radiochemotherapy should be performed in addition to surgery, preferentially as preoperative radiochemotherapy or as short-co…
Chromium thin films are deposited by combining direct current magnetron sputtering and high power impulse magnetron sputtering (HiPIMS) on a single cathode in an industrial deposition system. While maintaining a constant deposition rate and unchanged metal ion energy distribution function, the fraction of the total po…
We study the properties of an array of Au ring nanoantennas fed by an ensemble of coherent emitters. The luminescence of the emitters is strongly enhanced at certain wavelengths due to the excitation of two types of resonances-the diffractive Rayleigh anomalies associated with the opening of new diffraction orders and…
INTRODUCTION: The blood-brain barrier (BBB) is a selectively permeable micro-vascular unit which prevents many central nervous system (CNS)-targeted compounds from reaching the brain. A significant problem in CNS drug development is the ability to model BBB permeability in a timely, reproducible and cost-effective man…
The complex interplay of proteins and other molecules, often in the form of large transitory assemblies, are critical to cellular function. Today, X-ray crystallography and electron cryo-microscopy (cryo-EM) are routinely used to image these macromolecular complexes, though often at limited resolutions. Despite the ra…
Abstract In this paper, Pt nanoparticles were successfully prepared by modified polyol method using silver nitrate as an effective structure-modifying agent. The characterization of Pt nanoparticles was investigated by using UV-Vis-NIR spectroscopy, transmission electron microscopy (TEM) and high resolution (HR) TEM,…
We study the propagation properties of surface plasmon polaritons on a Cu surface by means of photoemission electron microscopy. Use of a CMOS process to fabricate the Cu thin film is shown to enable very high propagation distances (up to 65 μm at 750 nm wavelength), provided that the copper native oxide is removed. A…
Spinal cord injury (SCI) is a serious clinical situation for which no suitable drug therapy exists. SCI often results in paraplegia or quadriplegia and, apart from the personal trauma leads to huge costs to society for rehabilitation or day-to-day life support. Sensory motor dysfunction following SCI is mainly a conse…
The derivation of mean-square displacements from elastic incoherent neutron scattering (EINS) of proteins is examined, with the aid of experiments on camphor-bound cytochrome P450cam and complementary molecular dynamics simulations. It is shown that a q(4) correction to the elastic incoherent structure factor (where q…
This paper presents a computational investigation of the response of steel beam-column assemblies with moment connections under monotonic loading conditions simulating a column removal scenario. Two beam-column assemblies are analyzed, which incorporate (1) welded unreinforced flange bolted web connections, and (2) re…
The polymorph control of glycine in D 2 O solution is successfully demonstrated by a laser trapping technique using a linearly or circularly polarized CW near-infrared laser beam. Focusing each laser beam into an air/solution interface of the solution always generates the stable crystal polymorph of either α- or γ-for…
BACKGROUND: Due to the extensive use of phosphates in industry, agriculture and households, the phosphate - γ-alumina interactions are important for understanding its detrimental contribution to eutrophication in lakes and rivers. In situ Fourier transform infrared (FTIR) spectroscopy can provide more detailed informa…
We investigated the effect of a reducing subsurface Ti interstitial defect on the structure and reactivity of thin water layers adsorbed on the majority anatase(101) surface of titanium oxide using ab initio molecular dynamics simulations. We find that standard DFT-GGA and the DFT+ U method predict similar energetics…
Conserved uncharacterized genes account for ~30% of genes in both eukaryotic and bacterial genomes and are predicted to encode what are often termed "conserved hypothetical proteins." Many of these proteins have a wide phylogenetic distribution and might play important roles in conserved cellular pathways. Using the b…
To further investigate the influence of dye architecture on dye-sensitized solar cell (DSSC) performance, some near-infrared absorbing quinoline-based squaraine dyes ( 4a, 4b, and 4c ) with different conjugated degrees carrying carboxylic or sulfonic groups as anchoring groups were designed, prepared, and applied as s…
We perform the first high-level ab initio calculations (MP2) on crystalline aspirin using a newly developed fragment-based QM/MM method. Contrary to earlier density functional theory predictions, the two polymorphs are virtually degenerate, which is consistent with experimentally observed intergrowth structures. This…
We demonstrate a 15-fold enhancement of solid-state NMR signals via dynamic nuclear polarization (DNP) based on a stable, naturally occurring radical in a protein: the flavin mononucleotide (FMN) semiquinone of flavodoxin. The line width of flavodoxin's EPR signal suggests that the dominant DNP mechanism is the solid…
Cobalt based oxygen evolution catalysts (Co–Pi) were loaded on the surface of ZnO by photochemical deposition in a neutral phosphate buffer solution containing Co 2+ ions. Structural, morphological, and optical properties of the samples were characterized by X-ray diffraction (XRD), field emission scanning electron mi…
cis-Diamminedichloroplatinum(II) (cisplatin) is able to interact with human superoxide dismutase (hSOD1) in the disulfide oxidized apo form with a dissociation constant of 37 ± 3 μM through binding cysteine 111 (Cys111) located at the edge of the subunit interface. It also binds to Cu(2)-Zn(2) and Zn(2)-Zn(2) forms of…
To elucidate the biological functions of small (p)ppGpp synthetases YjbM and YwaC of Bacillus subtilis, we constructed RIK1059 and RIK1066 strains carrying isopropyl-β-D-thiogalactopyranoside (IPTG) inducible yjbM and ywaC genes, respectively, in the ΔrelA ΔyjbM ΔywaC triple mutant background. While the uninduced and…