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60 ta ish

Ish: A computer-based study on the potential flutamide drug biosensor based on transition metal modified BN nanocage

  1. cclib: A library for package‐independent computational chemistry algorithms

    Noel M. O’Boyle, Adam L. Tenderholt, Karol M. Langner

    Maqola200732 iqtibos
    ABI

  2. Density-functional exchange-energy approximation with correct asymptotic behavior

    Axel D. Becke

    Maqola198829 iqtibos
    ABI

  3. Detection of phosgene by Sc-doped BN nanotubes: A DFT study

    Javad Beheshtian, Ali Ahmadi Peyghan, Zargham Bagheri

    Maqola201210 iqtibos
    ABI

  4. Semiconductor physical electronics

    Slobodan Mijalković

    Maqola19979 iqtibos
    ABI

  5. Density Functionals with Broad Applicability in Chemistry

    Yan Zhao, Donald G. Truhlar

    Maqola20088 iqtibos
    ABI

  6. Why the Standard B3LYP/6-31G* Model Chemistry Should Not Be Used in DFT Calculations of Molecular Thermochemistry: Understanding and Correcting the Problem

    Holger Kruse, Lars Goerigk, Stefan Grimme

    Maqola20128 iqtibos
    ABI

  7. The ability of ZnO and MgO nanocages for adsorption and sensing performance of anticancer drug detection

    Mohamed J. Saadh, Ali B.M. Ali, Zahraa A. Hanoon +5

    Maqola20258 iqtibos
    ABI

  8. The recent advancement of low-dimensional nanostructured materials for drug delivery and drug sensing application: A brief review

    Hamidur Rahman, Md. Rakib Hossain, Tahmina Ferdous

    Sharh maqola20207 iqtibos
    ABI

  9. BP-biphenylene monolayers: A promising anode material for high-performance magnesium-ion batteries

    Rahadian Zainul, Ali Basem, Ahmed K. Nemah +6

    Maqola20247 iqtibos
    ABI

  10. Analysis of electronic properties and sensing applications in Graphene/BC3 heterostructures

    Mohamed J. Saadh, Ali B.M. Ali, Hassan A. Kenjrawy +7

    Maqola20246 iqtibos
    ABI

  11. Ruddlesden-Popper compound Sr2TiO4 doped with chalcogens for optoelectronic applications: Insights from first-principle calculations

    Meryem Ziati, Naoual Bekkioui, H. Ez‐Zahraouy

    Maqola20215 iqtibos
    ABI

  12. Adsorption of NH3, HCHO, SO2, and Cl2 gasses on the o-B2N2 monolayer for its potential application as a sensor

    Mohamed J. Saadh, Ali Basem, Zahraa A. Hanoon +7

    Maqola20245 iqtibos
    ABI

  13. Adsorption of Phosgene Gas on Pristine and Copper-Decorated B<sub>12</sub>N<sub>12</sub> Nanocages: A Comparative DFT Study

    Shahid Hussain, Riaz Hussain, Muhammad Yasir Mehboob +7

    Maqola20204 iqtibos
    ABI

  14. Study on pressure-induced band gap modulation and physical properties of direct band gap Ca3NX3 (X = Cl, Br) for optoelectronic and thermoelectric applications

    Maruf Al Yeamin, Asif Hosen, Md. Adil Hossain +6

    Maqola20244 iqtibos
    ABI

  15. Theoretical study of dibenzotetraaza[14]annulene complexes with first row transition metals

    Natanael de Sousa Sousa, Roberto Batista de Lima, Adilson Luís Pereira Silva +3

    Maqola20144 iqtibos
    ABI

  16. Noise and the Kelvin method

    Iain D. Baikie, Susan MacKenzie, P. J. Estrup +1

    Maqola19914 iqtibos
    ABI

  17. Understanding delivery and adsorption of Flutamide drug with ZnONS based on: Dispersion-corrected DFT calculations and MD simulations

    P. Niknam, Saeed Jamehbozorgi, Mahyar Rezvani +1

    Maqola20213 iqtibos
    ABI

  18. Biosensor Technologies for Early Detection and Quantification of Plant Pathogens

    Kazbek Dyussembayev, Prabhakaran Thanjavur Sambasivam, Ido Bar +3

    Sharh maqola20213 iqtibos
    ABI

  19. Computational Notes on the Chemical Stability of Flutamide

    M.A.M. El-Mansy, Osama Osman, Abdel Aziz Mahmoud +97

    Maqola20203 iqtibos
    ABI

  20. Theoretical studies with B12N12 as a toxic gas sensor: a review

    Adilson Luís Pereira Silva, Natanael de Sousa Sousa, Jaldyr de Jesus Gomes Varela Júnior

    Sharh maqola20233 iqtibos
    ABI

  21. Nanocrystal Growth on Graphene with Various Degrees of Oxidation

    Hailiang Wang, Joshua T. Robinson, Georgi Diankov +1

    MaqolaOchiq kirish20102 iqtibos
    ABI

  22. Thermodynamic and reactivity descriptors Studies on the interaction of Flutamide anticancer drug with nucleobases: A computational view

    Maedeh Kamel, Kamal Mohammadifard

    MaqolaOchiq kirish20212 iqtibos
    ABI

  23. Flutamide drug interaction studies on graphdiyne nanotube – A first-principles study

    V. Nagarajan, R. Chandiramouli

    Maqola20192 iqtibos
    ABI

  24. Electron Emission from Metals as a Function of Temperature

    Owen Willans Richardson

    Maqola19242 iqtibos
    ABI

  25. Deciphering the mystery of hexagon holes in an all-boron graphene α-sheet

    Timur R. Galeev, Qiang Chen, Jin‐Chang Guo +6

    Maqola20112 iqtibos
    ABI