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36 ta ish

Ish: A comparative DFT study of the delivery performance of Au cluster decorated MoSe2 and WSe2 nanosheets for hydroxyurea and nitrosourea anticancer drugs

  1. Special points for Brillouin-zone integrations

    Hendrik J. Monkhorst, J.D. Pack

    Maqola197675 iqtibos
    ABI

  2. Self-Consistent Equations Including Exchange and Correlation Effects

    W. Kohn, L. J. Sham

    MaqolaOchiq kirish196559 iqtibos
    ABI

  3. Sarlavhasiz

    Boshqa52 iqtibos
    ABI

  4. The SIESTA method for<i>ab initio</i>order-<i>N</i>materials simulation

    José M. Soler, Emilio Artacho, Julian D. Gale +4

    MaqolaOchiq kirish200220 iqtibos
    ABI

  5. Generalized Gradient Approximation Made Simple [Phys. Rev. Lett. 77, 3865 (1996)]

    John P. Perdew, Kieron Burke, Matthias Ernzerhof

    MaqolaOchiq kirish199718 iqtibos
    ABI

  6. 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

  7. Toward functionalization of ZnO nanotubes and monolayers with 5-aminolevulinic acid drugs as possible nanocarriers for drug delivery: a DFT based molecular dynamic simulation

    Masoumeh Mohammadzaheri, Saeed Jamehbozorgi, Masoud Darvish Ganji +2

    Maqola20235 iqtibos
    ABI

  8. Unravelling performance of honeycomb structures as drug delivery systems for the isoniazid drug using DFT-D3 correction dispersion and molecular dynamic simulations

    Masoud Darvish Ganji, Hyunseok Ko, Saeed Jamehbozorgi +5

    Maqola20245 iqtibos
    ABI

  9. A novel strategy for SO x removal by N-doped TiO 2 /WSe 2 nanocomposite as a highly efficient molecule sensor investigated by van der Waals corrected DFT

    Amirali Abbasi, Jaber Jahanbin Sardroodi

    Maqola20173 iqtibos
    ABI

  10. Investigation of aluminum nitride nanocarrier for drug delivery process of Favipiravir: A DFT study

    Mahmoud A. A. Ibrahim, Al‐shimaa S. M. Rady, Nayra A. M. Moussa +5

    Maqola20233 iqtibos
    ABI

  11. Pnictogen‐Based Enzymatic Phenol Biosensors: Phosphorene, Arsenene, Antimonene, and Bismuthene

    Carmen C. Mayorga‐Martinez, Rui Gusmão, Zdeněk Sofer +1

    Maqola20182 iqtibos
    ABI

  12. Corrosion protection performance of Laurhydrazide N′-propan-3-one (LHP) adsorbed on zinc surface: A DFT-MD simulation investigation

    Atyeh Rahmanzadeh, Mahyar Rezvani, Masoud Darvish Ganji +1

    Maqola20232 iqtibos
    ABI

  13. Sarlavhasiz

    Boshqa2 iqtibos
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  14. In Silico Adsorption of Lomustin anticancer drug on the surface of Boron Nitride nanotube

    Maryam Afshar, Roya Ranjineh Khojasteh, Roya Ahmadi +1

    Maqola20212 iqtibos
    ABI

  15. Sarlavhasiz

    Boshqa2 iqtibos
    ABI

  16. Chemotherapy‐induced neutropenia

    Jeffrey Crawford, David C. Dale, Gary H. Lyman

    Sharh maqola20042 iqtibos
    ABI

  17. Chemotherapy and amenorrhea: risks and treatment options

    Kutluk Oktay, Murat Sönmezer

    Sharh maqola20082 iqtibos
    ABI

  18. Geometry-controlled carbon nanostructures as effective drug delivery carriers for MAO enzyme inhibitors: A DFT study

    Milad Nouraliei, Mehrnoosh Karimkhani, S. Mansouri +1

    Maqola20212 iqtibos
    ABI

  19. A novel pentagonal BCN monolayer for sensing and drug delivery of nitrosourea and hydroxyurea anticancer drugs: A DFT outlook

    Rezvan Rahimi, Mohammad Solimannejad

    Maqola20242 iqtibos
    ABI

  20. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  21. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  22. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  23. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  24. Sarlavhasiz

    Boshqa1 iqtibos
    ABI

  25. Sarlavhasiz

    Boshqa1 iqtibos
    ABI