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70 ta ish

Ish: Relationship between structural properties and biological activity of (-)-menthol and some menthyl esters

  1. Self-consistent molecular orbital methods. XX. A basis set for correlated wave functions

    R. Krishnan, J. Stephen Binkley, Rolf Seeger +1

    Maqola198029 iqtibos
    ABI

  2. The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals

    Yan Zhao, Donald G. Truhlar

    Maqola200729 iqtibos
    ABI

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

    Stefan Grimme, Stephan Ehrlich, Lars Goerigk

    Maqola201125 iqtibos
    ABI

  4. SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules

    Antoine Daina, Olivier Michielin, Vincent Zoete

    Maqola201722 iqtibos
    ABI

  5. Universal Solvation Model Based on Solute Electron Density and on a Continuum Model of the Solvent Defined by the Bulk Dielectric Constant and Atomic Surface Tensions

    Aleksandr V. Marenich, Christopher J. Cramer, Donald G. Truhlar

    Maqola20098 iqtibos
    ABI

  6. Contracted Gaussian basis sets for molecular calculations. I. Second row atoms, <i>Z</i>=11–18

    A. D. McLean, G. S. Chandler

    Maqola19807 iqtibos
    ABI

  7. A new hybrid exchange–correlation functional using the Coulomb-attenuating method (CAM-B3LYP)

    Takeshi Yanai, David P. Tew, Nicholas C. Handy

    Maqola20046 iqtibos
    ABI

  8. Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen

    Thom H. Dunning

    Maqola19896 iqtibos
    ABI

  9. Compact contracted basis sets for third‐row atoms: Ga–Kr

    R. C. Binning, Larry A. Curtiss

    Maqola19905 iqtibos
    ABI

  10. Electron affinities of the first-row atoms revisited. Systematic basis sets and wave functions

    Rick A. Kendall, Thom H. Dunning, Robert J. Harrison

    Maqola19925 iqtibos
    ABI

  11. Determining atom‐centered monopoles from molecular electrostatic potentials. The need for high sampling density in formamide conformational analysis

    Curt M. Breneman, Kenneth B. Wiberg

    Maqola19905 iqtibos
    ABI

  12. General Strategy for Computing Nonlinear Optical Properties of Large Neutral and Cationic Organic Chromophores in Solution

    Enrico Benassi, Franco Egidi, Vincenzo Barone

    Maqola20154 iqtibos
    ABI

  13. Pharmacological and therapeutic effects of Mentha Longifolia L. and its main constituent, menthol

    Milad Moloudizargari, Peyman Mikaili, Sina Mojaverrostami +1

    Sharh maqola20133 iqtibos
    ABI

  14. A quadratically convergent Hartree—Fock (QC-SCF) method. Application to closed shell systems

    George B. Bacskay

    Maqola19813 iqtibos
    ABI

  15. Extension of Gaussian-2 theory to molecules containing third-row atoms Ga–Kr

    Larry A. Curtiss, Mark P. McGrath, Jean‐Philippe Blaudeau +3

    Maqola19953 iqtibos
    ABI

  16. Prediction of the Biological Activity Spectra of Organic Compounds Using the Pass Online Web Resource

    Dmitry Filimonov, Alexey A. Lagunin, Tatyana A. Gloriozova +4

    Maqola20142 iqtibos
    ABI

  17. Extension of Gaussian-1 (G1) theory to bromine-containing molecules

    Mark P. McGrath, Leo Radom

    Maqola19912 iqtibos
    ABI

  18. L-menthol exhibits antidepressive-like effects mediated by the modification of 5-HTergic, GABAergic and DAergic systems

    Weidong Wang, Yuanyuan Jiang, Enbo Cai +5

    Maqola20182 iqtibos
    ABI

  19. Menthol: An underestimated anticancer agent

    Yijia Zhao, Huafeng Pan, Wei Liu +8

    Sharh maqola20232 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