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Journal Abstract Search

202 related items for PubMed ID: 26342821

  • 1. Vibrational normal modes calculation in the crystalline state of methylated monosaccharides: Anomers of the methyl-D-glucopyranoside and methyl-D-xylopyranoside molecules.
    Taleb-Mokhtari IN, Lazreg A, Sekkal-Rahal M, Bestaoui N.
    Spectrochim Acta A Mol Biomol Spectrosc; 2016 Jan 15; 153():363-73. PubMed ID: 26342821
    [Abstract] [Full Text] [Related]

  • 2. Modified UBFF calculations of the alpha-L-fucopyranose molecule in the crystalline state.
    Taleb-Mokhtari IN, Rahal-Sekkal M, Vergoten G.
    Spectrochim Acta A Mol Biomol Spectrosc; 2003 Feb 15; 59(3):607-16. PubMed ID: 12524131
    [Abstract] [Full Text] [Related]

  • 3. Harmonic dynamics of alpha- and beta-methyl-D-galactopyranoside in the crystalline state.
    Sekkal N, Taleb-Mokhtari IN, Sekkal-Rahal M, Bleckmann P, Vergoten G.
    Spectrochim Acta A Mol Biomol Spectrosc; 2003 Oct 15; 59(12):2883-96. PubMed ID: 14499848
    [Abstract] [Full Text] [Related]

  • 4. Normal coordinates analyses of beta-D-allose and alpha-D-talose in the crystalline state.
    Reguieg C, Yousfi N, Sekkal-Rahal M.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Jul 15; 67(3-4):966-75. PubMed ID: 17049912
    [Abstract] [Full Text] [Related]

  • 5. Harmonic dynamics of beta-D-fructopyranose.
    Benbrahim N, Sekkal-Rahal M, Vergoten G.
    Spectrochim Acta A Mol Biomol Spectrosc; 2002 Nov 15; 58(13):3021-31. PubMed ID: 12477047
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  • 6. Normal coordinates analyses of disaccharides constituted by D-glucose, D-galactose and D-fructose units.
    Mahdad-Benzerdjeb A, Taleb-Mokhtari IN, Sekkal-Rahal M.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Oct 15; 68(2):284-99. PubMed ID: 17350882
    [Abstract] [Full Text] [Related]

  • 7. Density functional theory (DFT) and natural bond orbital (NBO) study of vibrational spectra and intramolecular hydrogen bond interaction of L-ornithine-L-aspartate.
    Li L, Wu C, Wang Z, Zhao L, Li Z, Sun C, Sun T.
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb 05; 136 Pt B():338-46. PubMed ID: 25448937
    [Abstract] [Full Text] [Related]

  • 8. Quantum chemical study on influence of intermolecular hydrogen bonding on the geometry, the atomic charges and the vibrational dynamics of 2,6-dichlorobenzonitrile.
    Agarwal P, Bee S, Gupta A, Tandon P, Rastogi VK, Mishra S, Rawat P.
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Feb 05; 121():464-82. PubMed ID: 24287056
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  • 11. Structural, vibrational and theoretical studies of anilinium trichloroacetate: new hydrogen bonded molecular crystal with nonlinear optical properties.
    Tanak H, Pawlus K, Marchewka MK, Pietraszko A.
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jan 24; 118():82-93. PubMed ID: 24041532
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  • 12. FT-IR and Raman spectra, ab initio and density functional computations of the vibrational spectra, molecular geometries and atomic charges of uracil and 5-methyluracil (thymine).
    Singh JS.
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb 25; 137():625-40. PubMed ID: 25244296
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  • 14. Quantum mechanical study and spectroscopic (FT-IR, FT-Raman, UV-Visible) study, potential energy surface scan, Fukui function analysis and HOMO-LUMO analysis of 3-tert-butyl-4-methoxyphenol by DFT methods.
    Saravanan S, Balachandran V.
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Sep 15; 130():604-20. PubMed ID: 24813291
    [Abstract] [Full Text] [Related]

  • 15. Vibrational and thermal analyses of multicomponent crystal forms of the anti-HIV drugs lamivudine and zalcitabine.
    Martins FT, Guimarães FF, Honorato SB, Ayala AP, Ellena J.
    J Pharm Biomed Anal; 2015 Jun 10; 110():76-82. PubMed ID: 25808817
    [Abstract] [Full Text] [Related]

  • 16. The spectroscopic (FT-IR, FT-Raman, dispersive Raman and NMR) study of ethyl-6-chloronicotinate molecule by combined density functional theory.
    Karabacak M, Calisir Z, Kurt M, Kose E, Atac A.
    Spectrochim Acta A Mol Biomol Spectrosc; 2016 Jan 15; 153():754-70. PubMed ID: 26483317
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  • 19. Natural bond orbital analysis, electronic structure and vibrational spectral analysis of N-(4-hydroxyl phenyl) acetamide: a density functional theory.
    Govindasamy P, Gunasekaran S, Ramkumaar GR.
    Spectrochim Acta A Mol Biomol Spectrosc; 2014 Sep 15; 130():621-33. PubMed ID: 24813292
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  • 20. DFT calculations and experimental FT-IR, FT-Raman, NMR, UV-Vis spectral studies of 3-fluorophenylboronic acid.
    Karabacak M, Kose E, Sas EB, Kurt M, Asiri AM, Atac A.
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb 05; 136 Pt B():306-20. PubMed ID: 25448934
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