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39 ta ish

Ish: Tuning Biomolecular Adsorption and Electronic Sensitivity of α-Phographene via Targeted Heteroatom Doping

  1. Multiwfn: A multifunctional wavefunction analyzer

    Tian Lu, Feiwu Chen

    Maqola2011135 iqtibos
    ABI

  2. VMD: Visual molecular dynamics

    William Humphrey, Andrew Dalke, Klaus Schulten

    Maqola199691 iqtibos
    ABI

  3. Natural bond orbital analysis: A critical overview of relationships to alternative bonding perspectives

    Frank Weinhold

    Maqola201211 iqtibos
    ABI

  4. Investigation of the adsorption of ozone molecules on TiO2/WSe2 nanocomposites by DFT computations: Applications to gas sensor devices

    Amirali Abbasi, Jaber Jahanbin Sardroodi

    Maqola20179 iqtibos
    ABI

  5. Noncovalent Interactions in Crystalline Picolinic Acid N-Oxide: Insights from Experimental and Theoretical Charge Density Analysis

    Anastasia V. Shishkina, Vladimir Zhurov, A.I. Stash +3

    Maqola20139 iqtibos
    ABI

  6. Computational Studies of Poly(vinylidene fluoride)—Single Wall Carbon Nanotube Systems

    Martin Bohlén, Kavitha Chelakara Satyanarayana, Kim Bolton

    Maqola20138 iqtibos
    ABI

  7. Electron/Hole Mobilities of Periodic DNA and Nucleobase Structures from Large-Scale DFT Calculations

    Hyuna Kwon, Anshuman Kumar, Mauro Del Ben +1

    Maqola20237 iqtibos
    ABI

  8. Fermi level induced band edge alignment and band bending in Ag3PO4/Cu2O p-n heterojunction for proficient photocatalytic applications

    Souman Pahi, Bikash Mahapatra, Abhijit Behera +2

    Maqola20236 iqtibos
    ABI

  9. A DFT/TD-DFT investigation of clozapine adsorption on B <sub>12</sub> Y <sub>12</sub> (Y = N, P) nanocages as vehicles for applications in schizophrenia treatment

    Charly Tedjeuguim Tsapi, Stanley Numbonui Tasheh, Aymard Didier Tamafo Fouégué +4

    Maqola20255 iqtibos
    ABI

  10. Antifouling Strategies for Selective <i>In Vitro</i> and <i>In Vivo</i> Sensing

    Cheng Jiang, Guixiang Wang, Robert Hein +3

    Sharh maqola20204 iqtibos
    ABI

  11. Thermal [3+2] cycloaddition reactions as most universal way for the effective preparation of five-membered nitrogen containing heterocycles

    Jowita Kras, Mikołaj Sadowski, Karolina Zawadzińska +4

    Maqola20234 iqtibos
    ABI

  12. Advances in nanotechnology-based approaches for the treatment of head and neck squamous cell carcinoma

    Bicai Tang, Rui Huang, MA Wen-juan

    Sharh maqola20244 iqtibos
    ABI

  13. Next-Generation Chemical Sensors: The Convergence of Nanomaterials, Advanced Characterization, and Real-World Applications

    Abniel Machín, Francisco Márquez

    Maqola20254 iqtibos
    ABI

  14. Multi-band simultaneous fits of transport data on p-type ScNiSb with including impurity conduction

    Yasutomo Kajikawa

    Maqola20224 iqtibos
    ABI

  15. Sarlavhasiz

    Boshqa4 iqtibos
    ABI

  16. Heteroatom-doped graphene materials: syntheses, properties and applications

    Xuewan Wang, Gengzhi Sun, Parimal Routh +3

    Sharh maqola20143 iqtibos
    ABI

  17. Gas storage potential of ExBox<sup>4+</sup>and its Li-decorated derivative

    Ranjita Das, Pratim Kumar Chattaraj

    Maqola20143 iqtibos
    ABI

  18. Sarlavhasiz

    Boshqa3 iqtibos
    ABI

  19. DFT study the application of carbon nitride monolayer with graphenylene networks for sensing of carmustine drug

    Ali B.M. Ali, Ammar Yasir Ahmed, G. Padma Priya +8

    MaqolaGraphene research and applicationsJournal of Molecular Graphics and Modelling20252 iqtibos
    ABI

  20. Sarlavhasiz

    Boshqa2 iqtibos
    ABI

  21. Sarlavhasiz

    Boshqa2 iqtibos
    ABI

  22. Sarlavhasiz

    Boshqa2 iqtibos
    ABI

  23. Sarlavhasiz

    Boshqa2 iqtibos
    ABI

  24. Sarlavhasiz

    Boshqa2 iqtibos
    ABI

  25. Sarlavhasiz

    Boshqa2 iqtibos
    ABI