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Работы, на которые ссылается эта работа

Работ: 72

Работа: Synthesis, crystal structures, DFT calculations, and hirshfeld surface analysis of tris(quinolin-8-olato-κ²N,O)cobalt(III) acetic acid monosolvate and Bis(μ-quinolin-8-olato-κ²N,O)diaquabis(nitrato-κ²O,O′)dinickel(II) complexes

  1. <i>SHELXT</i>– Integrated space-group and crystal-structure determination

    George M. Sheldrick

    Статья2014Цитирований: 119
    ABI

  2. Multiwfn: A multifunctional wavefunction analyzer

    Tian Lu, Feiwu Chen

    Статья2011Цитирований: 110
    ABI

  3. Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

    Chengteh Lee, Weitao Yang, Robert G. Parr

    Статья1988Цитирований: 84
    ABI

  4. VMD: Visual molecular dynamics

    William Humphrey, Andrew Dalke, Klaus Schulten

    Статья1996Цитирований: 77
    ABI

  5. Hirshfeld surface analysis

    Mark A. Spackman, Dylan Jayatilaka

    Статья2008Цитирований: 61
    ABI

  6. Towards quantitative analysis of intermolecular interactions with Hirshfeld surfaces

    Joshua J. McKinnon, Dylan Jayatilaka, Mark A. Spackman

    Статья2007Цитирований: 35
    ABI

  7. <i>Mercury 4.0</i>: from visualization to analysis, design and prediction

    Clare F. Macrae, Ioana Şovago, Simon J. Cottrell +8

    Статья2019Цитирований: 30
    ABI

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

    Axel D. Becke

    Статья1988Цитирований: 25
    ABI

  9. Effect of the damping function in dispersion corrected density functional theory

    Stefan Grimme, Stephan Ehrlich, Lars Goerigk

    Статья2011Цитирований: 25
    ABI

  10. CB-Dock2: improved protein–ligand blind docking by integrating cavity detection, docking and homologous template fitting

    Yang Liu, Xiaocong Yang, Jianhong Gan +3

    Статья2022Цитирований: 17
    ABI

  11. Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy

    Florian Weigend, Reinhart Ahlrichs

    Статья2005Цитирований: 15
    ABI

  12. The Protein Data Bank

    Helen M. Berman

    Статья2000Цитирований: 15
    ABI

  13. Synthesis of the Three Mixed-ligand Metal Complexes and One Organic Salt of 3,5-Dinitrobenzoic Acid for Biopharmaceutical Optimization Through Monoethanolamine: Structures and DFT Studies of Complexes

    Avazbek B. Ibragimov, Jamshid Ashurov, Aziz B. Ibragimov +1

    СтатьяNonlinear Optical Materials ResearchJournal of Chemical Crystallography2020Цитирований: 13
    ABI

  14. Two new 8-hydroxyquinoline derivatives as an efficient corrosion inhibitors for mild steel in hydrochloric acid: Synthesis, electrochemical, surface morphological, UV–visible and theoretical studies

    Mohamed Rbaa, F. Benhiba, I.B. Obot +4

    Статья2018Цитирований: 10
    ABI

  15. The fundamental nature and role of the electrostatic potential in atoms and molecules

    Peter Politzer, Jane S. Murray

    Статья2002Цитирований: 8
    ABI

  16. Software update: The <scp>ORCA</scp> program system—Version 5.0

    Frank Neese

    Статья2022Цитирований: 6
    ABI

  17. 8-Hydroxyquinolines in medicinal chemistry: A structural perspective

    Valentina Oliveri, Graziella Vecchio

    Обзорная статья2016Цитирований: 4
    ABI

  18. COSMO: a new approach to dielectric screening in solvents with explicit expressions for the screening energy and its gradient

    Andreas Klamt, Gerrit Schüürmann

    Статья1993Цитирований: 4
    ABI

  19. Metal organic framework based fluorescence sensor for detection of antibiotics

    Murugavelu Marimuthu, Selva Sharma Arumugam, Sabarinathan Devaraj +2

    Статья2021Цитирований: 4
    ABI

  20. The Role of Frontier Orbitals in Chemical Reactions (Nobel Lecture)

    Kenichi Fukui

    Статья1982Цитирований: 3
    ABI

  21. Crystal structure, Hirshfeld surface analysis and DFT studies of tetrakis(μ-3-nitrobenzoato-κ<sup>2</sup> <i>O</i> <sup>1</sup>:<i>O</i> <sup>1′</sup>)bis[(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)copper(II)] dimethylformamide disolvate

    Mavlonbek Ziyaev, Jamshid Ashurov, Alisher G. Eshimbetov +1

    СтатьяMetal-Organic Frameworks: Synthesis and ApplicationsActa Crystallographica Section E Crystallographic Communications2021Цитирований: 2
    ABI

  22. Preparation and Study of the Crystal Structure of a Complex Compound Based on Cobalt, 1,5-Disulfonaphthalene, and Ethylenediamine

    Zh. R. Suyunov, Kh. Kh. Turaev, Sh. A. Kasimov +2

    СтатьяCrystal structures of chemical compoundsCrystallography Reports2024Цитирований: 2
    ABI

  23. 8-Hydroxyquinolinium trichlorido(pyridine-2,6-dicarboxylic acid-κ<sup>3</sup> <i>O</i>,<i>N</i>,<i>O</i>′)copper(II) dihydrate

    Yusufjon Nazarov, Khayit Khudainazarovich Turaev, Jabbor Ruziboevich Suyunov +4

    СтатьяCrystal structures of chemical compoundsActa Crystallographica Section E Crystallographic Communications2024Цитирований: 2
    ABI

  24. Absolute electronegativity and hardness correlated with molecular orbital theory

    Ralph G. Pearson

    Статья1986Цитирований: 2
    ABI

  25. Synthesis, thermal behavior in oxidative and pyrolysis conditions, spectroscopic and DFT studies of some alkaline earth metals p-aminobenzoate complexes using TG-DTA, DSC, PXRD and EGA (TG-FTIR) techniques

    José Augusto Teixeira, Richard Perosa Fernandes, Guilherme Isquibola +4

    Статья2022Цитирований: 2
    ABI