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2301
Chemical, Spectral, Biological, and Toxicological Studies of Some Benzene Derivatives Used in Pharmaceuticals: In Silico Approach
Published 2024-12-01“…Herein, twenty benzene derivatives (BDs) have been studied in terms of their biological and physiochemical properties, and the compounds have also been investigated using quantum mechanical computations. Binding affinities and behaviors of all BDs have been investigated using molecular docking and nonbonding interactions on 3D crystal structures of human receptor proteins serum albumin (1AO6), free native cellulase CEL48F (1G9G), and human D-amino acid oxidase mutant (P219L) complexed with benzoate (6KBP). …”
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2302
Synthesis, Anti-Inflammatory Activity, and Docking Simulation of a Novel Styryl Quinolinium Derivative
Published 2024-12-01“…Density functional theory (DFT) analyses were conducted on the SQ structure to gain detailed insights into its active sites, energy gap, quantum properties, and electronic behavior. The biological evaluation of the compound was completed, assessing its antioxidant potential using DPPH radical scavenging assay. …”
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2303
Photofunctionalized Europium(III) complexes with circularly polarized luminescence
Published 2025-06-01“…The synthesized complex displayed significant circularly polarized luminescence (CPL) properties, exhibiting an absolute gCPL value of 0.025 and an absolute quantum yield of 4.09 %. With a 8 % sensitization efficiency and a 0.56 ms photoluminescent lifetime, this complex shows promise for potential applications in optoelectronic devices and chiral sensing. …”
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2304
Performance Improvements of Selective Emitters by Laser Openings on Large-Area Multicrystalline Si Solar Cells
Published 2014-01-01“…In addition, this optimal SE3 cell displays improved characteristics compared with other cells with a higher average value of external quantum efficiency (EQEavg = 68.6%) and a lower average value of power loss (Ploss = 2.33 mW/cm2). …”
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2305
A Trap-Assisted Photomultiplication-Type Organic Photodetector With High Detectivity From Visible to Shortwave Infrared Light
Published 2025-01-01“…By easily tunning the donor/acceptor ratio in bulk-heterojunction layer consisting Poly([2,6’-4,8-di(5-ethylhexylthienyl)benzo[1,2-b;3,3-b]dithiophene]{3-fluoro-2[(2-ethylhexyl)carbonyl] thieno[3,4-b]thiophenediyl}) (PTB7-Th) and a novel non-fullerene acceptor (NFA) pendant 2,2’-(((2,5-bis(2-octyldodecyl)-3,6-dioxo-2,3,5,6-tetrahydropyrrolo [3,4-c]pyrrole-1,4-diyl)bis(thiophene-5,2-diyl))bis(4-oxonaphthalene-3(4H)-yl-1(4H)-ylidene)) dimalononitrile named DPP-QC, the device shows specifically a high external quantum efficiency (EQE) value of 112% and specific detectivity (D*) over <inline-formula> <tex-math notation="LaTeX">$10^{10}$ </tex-math></inline-formula> Jones at 1200 nm at a light intensity of 0.108 mW/cm2. …”
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2306
Spatiotemporal dynamics and prevention strategies of cervical cancer incidence in Addis Ababa, Ethiopia: an ecological study
Published 2025-01-01“…Objective This study analysed the spatial and temporal patterns of cervical cancer incidence in Addis Ababa from 2012 to 2021.Design An ecological study was conducted from 1 September to 30 November 2023 to examine the spatiotemporal trends of cervical cancer incidence.Setting The research was conducted in Addis Ababa, the capital city of Ethiopia.Participants Included were all patients with clinically and/or histopathologically confirmed diagnoses of cervical cancer.Data analysis The study employed advanced analytical tools including R programming, Quantum Geographic Information System V.3.36.0, GeoDa V.1.2.2 and System for Automated Geoscientific Analyses GIS V.9.3.2. …”
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2307
Development of the residual knowledge tests on the general course of physics for the students of the National Research University MPEI
Published 2024-12-01“…An overview of the subject material is given, a structure of tests for assessment of residual knowledge on optics and quantum physics is developed. An analysis of the level of test tasks and options for their implementation at National Research University “Moscow Power Engineering Institute” using the intra-university system of distance testing is conducted. …”
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2308
Human development II: We Need an Integrated Theory for Matter, Life and Consciousness to Understand Life and Healing
Published 2006-01-01“…We suggest that life utilizes an unseen fine structure of the physical energy of the universe at a subparticular or quantum level to give information-directed self-organization; we give a first sketch of a possible fractal structure of the energy able to both contain and communicate biological information and carry individual and collective consciousness. …”
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2309
Distribution and Main Influencing Factors of Net Ecosystem Carbon Exchange in Typical Vegetation Ecosystems of Southern China
Published 2024-05-01“…However, after exceeding the light saturation point, changes in VPD had no significant effect on the LUE. (4) Compared with the vegetation in the TCME, that in the ECFE exhibited a 120.00% increase in annual ecosystem apparent quantum yield (X) and a 24.23% increase in maximum gross ecosystem exchange at light saturation (GEEmax), while the half-saturated light intensity (PAR0) decreased by 43.53%.…”
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2310
Semiclassical Estimates of Pressure-induced Line Widths for Infrared Absorption in Hot (Exo)planetary Atmospheres
Published 2025-01-01“…Advanced theoretical approaches (classical, semiclassical, and quantum mechanical), without mentioning their high computational cost, are also impracticable due to the lack of potential energy surfaces. …”
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2311
Unraveling Abnormal Thermal Quenching of Sub‐Gap Emission in β‐Ga2O3
Published 2025-01-01“…One channel is the nsnp‐ns2 transition of Sn2+, the other is donor‐acceptor pair recombination via (2VGa‐Sni)2− complex, which is energetically favorable as evidenced by density functional theory calculations. The semi‐classical quantum theory models fitting proves the transition from green to UV emissions with elevated temperature. …”
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2312
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2313
Luminescence properties of ZnSe single crystals co-doped with Fe and Cr
Published 2025-02-01“…In the blue light region, quantum dots (QDs) appear. These represent clusters of three Cr-containing octahedral complexes accompanied by Zn vacancies, anticipating the formation of spinel ZnCr2Se4 inclusions in the host chalcogenide ZnSe matrix.…”
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2314
Comprehensive multispectral and computational study of isoxazolidine derivative ‘ISoXD3’: Synthesis, spectral characteristics, DNA binding, and comparative effects of allyl and pro...
Published 2025-03-01“…Increased solvent polarity decreases fluorescence intensity and quantum yield, suggesting significant solvation effects. …”
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2315
Theoretical Investigation of the Structural, Spectroscopic, Electronic, and Pharmacological Properties of 4-Nerolidylcathecol, an Important Bioactive Molecule
Published 2019-01-01“…In this work, a theoretical DFT study of the vibrational, structural, and quantum properties of 4-nerolidylcatechol (4NRC) using the B3LYP/6-311G (2d,p) level is presented. …”
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2316
Spermine driven water deficit tolerance in early growth phases of sweet corn genotypes under hydroponic cultivation
Published 2025-01-01“…Spermine also reduced oxidative damage, as indicated by a 48.7% decrease in malondialdehyde levels in Tyson, and increased peroxidase activity, enhancing antioxidant defense in Messenger under severe water deprivation. The quantum efficiency of Photosystem II, which was significantly reduced by water deficit, showed substantial improvement with Spermine treatment, with increases of 107.2% in Tyson and 99.4% in Royalty under moderate water deprivation. …”
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2317
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2318
Ultra‐Broad Emission Copper Halide Scintillator‐Based X‐Ray Imager
Published 2025-01-01“…Benefiting from the large Stokes shift and ultra‐broad emission band enabled by the dual STE, the self‐absorption‐free TPACI scintillator exhibits efficient white light emission with a high photoluminescence quantum yields of 94.27%, a high light yield of ≈40124 photons MeV−1. …”
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2319
High-Coercivity Ferrimagnet Co₂FeO₂BO₃: XMCD Insights into Charge-Ordering and Cation Distribution
Published 2025-01-01“…The findings underline the suitability of Co<sub>2</sub>FeO<sub>2</sub>BO<sub>3</sub> for applications in extreme environments, such as low temperatures and high magnetic fields, where its unique magnetic topology and anisotropy can be harnessed for advanced technologies, including materials for space exploration and quantum devices. This XMCD study opens the door to the production of novel high-coercivity, lanthanide-free magnetic materials by showing that targeted substitution at specific crystallographic sites can significantly enhance the magnetic properties of such materials.…”
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2320
The Novel Methods for Analysis of Exosomes Released from Endothelial Cells and Endothelial Progenitor Cells
Published 2016-01-01“…Here we described novel methods for purification and phenotyping of EXs released from endothelial cells (ECs) and endothelial progenitor cells (EPCs) by combining microbeads and fluorescence quantum dots (Q-dots®) techniques. EXs from the culture medium of ECs and EPCs were isolated and detected with cell-specific antibody conjugated microbeads and second antibody conjugated Q-dots by using nanoparticle tracking analysis (NTA) system. …”
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