Асосий контентга ўтиш
AkademIndex

Маҳсулотлар

Ишлаб чиқувчилар учун

AkademBaseЭкотизим учун очиқ API
← Ишга қайтиш

Ушбу иш иқтибос қилган ишлар

37 та иш

Иш: Unveiling the structural and electronic features of a hexamethylenetetramine complex of zinc 3-hydroxybenzoate: crystal structure, hirshfeld surface, DFT, and molecular docking studies

  1. Crystal structure refinement with<i>SHELXL</i>

    George M. Sheldrick

    Мақола2014162 иқтибос
    ABI

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

    George M. Sheldrick

    Мақола2014119 иқтибос
    ABI

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

    Chengteh Lee, Weitao Yang, Robert G. Parr

    Мақола198884 иқтибос
    ABI

  4. Density-functional thermochemistry. III. The role of exact exchange

    Axel D. Becke

    Мақола199374 иқтибос
    ABI

  5. Hirshfeld surface analysis

    Mark A. Spackman, Dylan Jayatilaka

    Мақола200861 иқтибос
    ABI

  6. Towards quantitative analysis of intermolecular interactions with Hirshfeld surfaces

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

    Мақола200735 иқтибос
    ABI

  7. AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading

    Oleg Trott, Arthur J. Olson

    Мақола200929 иқтибос
    ABI

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

    Axel D. Becke

    Мақола198825 иқтибос
    ABI

  9. Structure validation in chemical crystallography

    Anthony L. Spek

    Мақола200925 иқтибос
    ABI

  10. <i>WinGX</i>and<i>ORTEP for Windows</i>: an update

    Louis J. Farrugia

    Мақола20127 иқтибос
    ABI

  11. Bonded-atom fragments for describing molecular charge densities

    F. L. Hirshfeld

    Мақола19776 иқтибос
    ABI

  12. <i>Ab initio</i> effective core potentials for molecular calculations. Potentials for the transition metal atoms Sc to Hg

    P. Jeffrey Hay, Willard R. Wadt

    Мақола19855 иқтибос
    ABI

  13. Visualisation and characterisation of voids in crystalline materials

    Michael J. Turner, Joshua J. McKinnon, Dylan Jayatilaka +1

    Мақола20105 иқтибос
    ABI

  14. Crystal structure, Hirshfeld surfaces and DFT computation of NLO active (2E)-2-(ethoxycarbonyl)-3-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino] prop-2-enoic acid

    Perumal Venkatesan, Subbiah Thamotharan, Andivelu Ilangovan +2

    Мақола20155 иқтибос
    ABI

  15. Quantitative analysis of intermolecular interactions in orthorhombic rubrene

    Venkatesha R. Hathwar, Mattia Sist, Mads R. V. Jørgensen +6

    Мақола20154 иқтибос
    ABI

  16. Diaquabis(2-bromobenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i><sup>1</sup>)zinc(II)

    Tuncer Hökelek, Hakan Dal, B. Tercan +2

    Мақола20092 иқтибос
    ABI

  17. Synthesis, structural, spectroscopic characterization, and structural comparison of 3-hydroxybenzoate and nicotinamide/N,N-diethylnicotinamide mixed ligand complexes with Zn(II)

    Dursun Ali Köse, H. Necefoğlu, Onur Şahın +1

    Мақола20112 иқтибос
    ABI

  18. Сарлавҳасиз

    Бошқа1 иқтибос
    ABI

  19. Сарлавҳасиз

    Бошқа1 иқтибос
    ABI

  20. Сарлавҳасиз

    Бошқа1 иқтибос
    ABI

  21. Сарлавҳасиз

    Бошқа1 иқтибос
    ABI

  22. Сарлавҳасиз

    Бошқа1 иқтибос
    ABI

  23. Сарлавҳасиз

    Бошқа1 иқтибос
    ABI

  24. Сарлавҳасиз

    Бошқа1 иқтибос
    ABI

  25. Сарлавҳасиз

    Бошқа1 иқтибос
    ABI