All Stories

  1. Molecular structure of aurothioglucose: a comprehensive computational study

    Article • Tetrahedron, March 2015, Elsevier

    Professor Sedat Karabulut, Professor Jerzy Leszczynski

  2. Combining ab initio calculations and Fourier-transform infrared (FT-IR) spectroscopy for quantitative analysis of multicomponent systems in solution: Tautomer proportions of ethyl acetoacetate

    Article • Vibrational Spectroscopy, September 2014, Elsevier

    Professor Sedat Karabulut, Professor Jerzy Leszczynski

  3. Reduction of aflatoxin B1 to aflatoxicol: A comprehensive DFT study provides clues to its toxicity

    Article • Journal of the Science of Food and Agriculture, April 2014, Wiley

    Professor Sedat Karabulut, Professor Jerzy Leszczynski

  4. Modeling the intermolecular interactions: Molecular structure of N-3-hydroxyphenyl-4-methoxybenzamide

    Article • Journal of Molecular Graphics and Modelling, March 2014, Elsevier

    Professor Sedat Karabulut, Professor Jerzy Leszczynski

  5. Detection of tautomer proportions of dimedone in solution: a new approach based on theoretical and FT-IR viewpoint

    Article • Journal of Computer-Aided Molecular Design, August 2013, Springer Science + Business Media

    Professor Sedat Karabulut, Professor Jerzy Leszczynski

  6. Anomeric and rotameric preferences of glucopyranose in vacuo, water and organic solvents

    Article • Journal of Molecular Modeling, June 2013, Springer Science + Business Media

    Professor Sedat Karabulut, Professor Jerzy Leszczynski

  7. An FT-IR and DFT based new approach for the detection of tautomer proportions in solution

    Article • Journal of Molecular Structure, September 2012, Elsevier

    Professor Sedat Karabulut

  8. Detection of relative dimer and rotamer concentrations of diacetamide in different solvents by FT-IR spectroscopy and DFT calculations

    Article • Vibrational Spectroscopy, November 2011, Elsevier

    Professor Sedat Karabulut, Professor massimo mella

  9. Supramolecular lead(II) azide complex of 2,6-diacetylpyridine dihydrazone: synthesis, molecular structure, and biological activity

    Article • Journal of Coordination Chemistry, September 2009, Taylor & Francis

    Professor Sedat Karabulut

  10. Synthesis, characterization, crystal structure and biological activity of the cobalt(IV) complex of 2,6-diacetylpyridine dioxime: [Co(dapdo)2]

    Article • Transition Metal Chemistry, February 2007, Springer Science + Business Media

    Professor Sedat Karabulut