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Showing 61-80 of 10,000 results
  1. Investigating the potential of monocyclic B9N9 and C18 rings for the electrochemical sensing, and adsorption of carbazole-based anti-cancer drug derivatives: DFT-based first-principle study

    Context

    For the first time, the use of monocyclic rings C 18 and B 9 N 9 as sensors for the sensing of carbazole-based anti-cancer drugs, such as...

    Yumna Niamat, Junaid Yaqoob, ... Tansir Ahamad in Journal of Molecular Modeling
    Article 03 July 2024
  2. ZnO NPs induce miR-342-5p mediated ferroptosis of spermatocytes through the NF-κB pathway in mice

    Background

    Zinc oxide nanoparticle (ZnO NP) is one of the metal nanomaterials with extensive use in many fields such as feed additive and textile,...

    Guangyu Liu, **g Lv, ... Zhongliang Jiang in Journal of Nanobiotechnology
    Article Open access 03 July 2024
  3. Computational studies on a selection of phosphite esters as antioxidants for polymeric materials

    Context

    Phosphite esters, a class of organo-phosphorus compounds, are widely used as non-discolouring antioxidants in many polymeric products. Apart...

    A. M. Karthika, Tiju Thomas, Cyril Augustine in Journal of Molecular Modeling
    Article 03 July 2024
  4. Date estimation of fabrication and repair of Color garments encouragement banner

    The Color Garments Encouragement Banner was designated a Korean Heritage in 2014 to recognize it as the most significant object of the color garments...

    Seonghee Pak, Boyeon An, Changsang Yun in Fashion and Textiles
    Article Open access 03 July 2024
  5. Effects of isotropic stress on the band structure elastic, optical, thermal, and x-ray diffraction properties of TiSnO3

    Background

    Cubic perovskite titanium stannous oxide (TiSnO3) is a promising material for various applications due to its functional properties....

    M. Sana Ullah Sahar, M. Ijaz Khan, ... Khaled Fahmi Fawy in Journal of Molecular Modeling
    Article 03 July 2024
  6. Nanobody peptide conjugate: a novel CD163 based broad neutralizing strategy against porcine reproductive and respiratory syndrome virus

    Background

    Porcine reproductive and respiratory syndrome virus (PRRSV) is a prevalent swine pathogen, which has caused adverse impact on the global...

    Haotian Yang, Meiqi Sun, ... Fang He in Journal of Nanobiotechnology
    Article Open access 02 July 2024
  7. Ab initio investigation on the mechanism of SO2 activation by P/B intermolecular frustrated Lewis pairs

    Context

    In silico study investigates the activation of sulfur dioxide by newly designed frustrated Lewis pairs, i.e., [P( t Bu) 3 …B(C 2 NBSHF 2 ) 3 ], where...

    Swapan Sinha, Santanab Giri in Journal of Molecular Modeling
    Article 02 July 2024
  8. Impact of do** with organic dopants and mixed do** with alkali metals and organic dopants on the absorption, electronic, optoelectronic, thermodynamic and nonlinear optical properties of dibenzo[b,def]chrysene in gaseous media: DFT and TD-DFT studies

    Context

    In this study, we evaluate the geometrical, absorption, optoelectronic, electronic, nonlinear optical (NLO) and thermodynamic properties of...

    C. D. Ribouem A. Bessong, M. T. Ottou Abe, ... J. M. B. Ndjaka in Journal of Molecular Modeling
    Article 02 July 2024
  9. Exploring Bacillus species xylanases for industrial applications: screening via thermostability and reaction modelling

    Context

    Xylanases derived from Bacillus species hold significant importance in various large-scale production sectors, with increasing demand driven...

    Sree Agash S.G, R. Rajasekaran in Journal of Molecular Modeling
    Article 02 July 2024
  10. Impact of SOFC anode carbon deposition and hydrogen adsorption on the cell performance by molecular simulation

    Context

    This study primarily investigates the changes in carbon adsorption capacity and hydrogen adsorption capacity on the anode catalyst surface...

    Hsin-Yi Lai, Ding-Yi Cheng, Yen-Hsin Chan in Journal of Molecular Modeling
    Article 02 July 2024
  11. Zno nanoparticles: improving photosynthesis, shoot development, and phyllosphere microbiome composition in tea plants

    Background

    Nanotechnology holds revolutionary potential in the field of agriculture, with zinc oxide nanoparticles (ZnO NPs) demonstrating advantages...

    Hao Chen, Yujie Song, ... Kai Fan in Journal of Nanobiotechnology
    Article Open access 02 July 2024
  12. Investigating the optical properties and electronic structure of gallium phosphide nanotubes doped with arsenic via implementing first-principles calculations

    Context

    This study investigates the impact of arsenic do** on the optical characteristics and electronic structure of zigzag (8, 0) and armchair (4,...

    Sameer Nawaf, Jamal M. Rzaij, ... Moaaed Motlak in Journal of Molecular Modeling
    Article 02 July 2024
  13. Novel two-dimensional HfSi2N4 monolayer with excellent bandgap modulation and electronic properties modulation

    Abstract

    The bandgap modulation and electronic properties modulation of two-dimensional HfSi 2 N 4 monolayer induced by strain, electric field and...

    Mingyang Yang, Haiming Huang, Wenyu Zhao in Journal of Molecular Modeling
    Article 02 July 2024
  14. Functional hydrogels for hepatocellular carcinoma: therapy, imaging, and in vitro model

    Hepatocellular carcinoma (HCC) is among the most common malignancies worldwide and is characterized by high rates of morbidity and mortality, posing...

    **aoying Xu, Yu Liu, ... Bing Liu in Journal of Nanobiotechnology
    Article Open access 01 July 2024
  15. Recent advances in gene delivery nanoplatforms based on spherical nucleic acids

    Gene therapy is a therapeutic option for mitigating diseases that do not respond well to pharmacological therapy. This type of therapy allows for...

    Nazila Valatabar, Fatemeh Oroojalian, ... Amirhossein Sahebkar in Journal of Nanobiotechnology
    Article Open access 01 July 2024
  16. NIR-responsive electrospun nanofiber dressing promotes diabetic-infected wound healing with programmed combined temperature-coordinated photothermal therapy

    Background

    Diabetic wounds present significant challenges, specifically in terms of bacterial infection and delayed healing. Therefore, it is crucial...

    **lang Fu, Ding Wang, ... Hao Cheng in Journal of Nanobiotechnology
    Article Open access 01 July 2024
  17. Application of metal-organic frameworks in infectious wound healing

    Metal-organic frameworks (MOFs) are metal-organic skeleton compounds composed of self-assembled metal ions or clusters and organic ligands. MOF...

    **nyu Zhao, Zenghong Chen, ... **anwen Wang in Journal of Nanobiotechnology
    Article Open access 01 July 2024
  18. Targeting delivery of miR-146a via IMTP modified milk exosomes exerted cardioprotective effects by inhibiting NF-κB signaling pathway after myocardial ischemia-reperfusion injury

    Reperfusion therapy is critical for saving heart muscle after myocardial infarction, but the process of restoring blood flow can itself exacerbate...

    Wan-ting Meng, **g Zhu, ... Guang Ji in Journal of Nanobiotechnology
    Article Open access 01 July 2024
  19. Cardiac-derived extracellular vesicles improve mitochondrial function to protect the heart against ischemia/reperfusion injury by delivering ATP5a1

    Background

    Numerous studies have confirmed the involvement of extracellular vesicles (EVs) in various physiological processes, including cellular...

    Xuan Liu, Qingshu Meng, ... **aohui Zhou in Journal of Nanobiotechnology
    Article Open access 01 July 2024
  20. Enhanced content-based fashion recommendation system through deep ensemble classifier with transfer learning

    With the rise of online shop** due to the COVID-19 pandemic, Recommender Systems have become increasingly important in providing personalized...

    Buradagunta Suvarna, Sivadi Balakrishna in Fashion and Textiles
    Article Open access 01 July 2024
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