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OpenAlex konusu

Spectroscopy and Quantum Chemical Studies

Bu sayfa OpenAlex konu etiketine göre çalışmaları ve o konuda görünen akademisyenleri listeler. YÖKSİS temel alan / yan dal değildir.

OpenAlex 1.006 eser 27 yazar konusu

Çalışmalar

1.006 eser

  1. Anisotropy of fluctuation dynamics of proteins with an elastic network model 2001
    YÖKSİS SJR Q1 JCR Q1 OpenAlex üst %10 OpenAlex 98.3%

    Özet henüz yok.

  2. Gaussian Dynamics of Folded Proteins 1997
    YÖKSİS SJR Q1 JCR Q1 OpenAlex üst %10 OpenAlex 92.6%

    Vibrational dynamics of folded proteins is studied using a Gaussian model in which the protein is viewed as a network, residues representing the junctions, and the connectivity being established by a single parameter harmonic potential. Application to seven proteins showed that the local packing density plays a major…

  3. FTIR spectroscopic characterization of protein structure in aqueous and non aqueous media 1999
    YÖKSİS SJR Q2 JCR Q3 OpenAlex 58.7%

    Özet henüz yok.

  4. Vibrational dynamics of folded proteins: Significance of slow and fast motions in relation to function and stability 1998
    YÖKSİS SJR Q1 JCR Q1 OpenAlex üst %10 OpenAlex 90.7%

    A single-parameter harmonic Hamiltonian based on local packing density and contact topology is proposed for studying residue fluctuations in native proteins. The internal energy obeys an equipartition law, and free energy changes result from entropy fluctuations only. Frequency--wave-number maps show communication bet…

  5. Matrix-Isolation Infrared and Theoretical Studies of the Glycine Conformers 1998
    OpenAlex üst %10 OpenAlex 98.5%

    The IR spectra of nonionized glycine and its deuterated derivatives isolated in the low-temperature argon matrices have been measured, and for the first time the infrared spectral characteristics of the three most stable conformers have been determined and assigned. Correlated level ab initio and density functional th…

  6. turboTDDFT - A code for the simulation of molecular spectra using the Liouville-Lanczos approach to time-dependent density-functional perturbation theory 2011
    YÖKSİS SJR Q1 JCR Q1 OpenAlex üst %10 OpenAlex 96.0%

    Özet henüz yok.

  7. X ray absorption spectroscopy and X ray Raman scattering of water andice an experimental view 2010
    YÖKSİS SJR Q2 JCR Q2 OpenAlex üst %10 OpenAlex 97.2%

    Özet henüz yok.

  8. Discrete stages in the solvation and ionization of hydrogen chloride adsorbed on ice particles 2002
    YÖKSİS SJR Q1 JCR Q1 OpenAlex üst %10 OpenAlex 98.7%

    Özet henüz yok.

  9. Thermodynamics of complex coacervation 2017
    YÖKSİS SJR Q1 JCR Q1 OpenAlex üst %1 OpenAlex 99.2%

    Özet henüz yok.

  10. Designer phospholipid capping ligands for soft metal halide nanocrystals 2023
    OpenAlex üst %1 OpenAlex 99.5%

    Abstract The success of colloidal semiconductor nanocrystals (NCs) in science and optoelectronics is inextricable from their surfaces. The functionalization of lead halide perovskite NCs1–5 poses a formidable challenge because of their structural lability, unlike the well-established covalent ligand capping of convent…

  11. Vibrational spectra of acid and alkaline glycine salts 1998
    OpenAlex 57.0%

    Özet henüz yok.

  12. Intermolecular hydrogen bonds interactions in water clusters of ammonium sulfamate: FTIR, X-ray diffraction, AIM, DFT, RDG, ELF, NBO analysis 2021
    YÖKSİS SJR Q1 JCR Q1 OpenAlex üst %1 OpenAlex 99.4%

    Özet henüz yok.

Akademisyenler

27 akademisyen