These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

150 related articles for article (PubMed ID: 17287876)

  • 1. Theoretical investigation of the EPR hyperfine coupling constants in amino derivatives.
    Rogowska A; Kuhl S; Schneider R; Walcarius A; Champagne B
    Phys Chem Chem Phys; 2007 Feb; 9(7):828-36. PubMed ID: 17287876
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Is the spin-orbit coupling important in the prediction of the 51V hyperfine coupling constants of V(IV) O2+ species? ORCA versus Gaussian performance and biological applications.
    Micera G; Garribba E
    J Comput Chem; 2011 Oct; 32(13):2822-35. PubMed ID: 21735449
    [TBL] [Abstract][Full Text] [Related]  

  • 3. The g-values and hyperfine coupling of amino acid radicals in proteins: comparison of experimental measurements with ab initio calculations.
    Un S
    Magn Reson Chem; 2005 Nov; 43 Spec no.():S229-36. PubMed ID: 16235221
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Radical cations from dipyridinium derivatives: a combined EPR and DFT study.
    Stipa P
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Jun; 64(3):653-9. PubMed ID: 16388981
    [TBL] [Abstract][Full Text] [Related]  

  • 5. A DFT study of EPR parameters in Cu(II) complexes of the octarepeat region of the prion protein.
    Bruschi M; De Gioia L; Mitrić R; Bonacić-Koutecký V; Fantucci P
    Phys Chem Chem Phys; 2008 Aug; 10(31):4573-83. PubMed ID: 18665307
    [TBL] [Abstract][Full Text] [Related]  

  • 6. A systematic comparison of second-order polarization propagator approximation and equation-of-motion coupled cluster singles and doubles C-C, C-N, N-N, C-H, and N-H spin-spin coupling constants.
    Del Bene JE; Alkorta I; Elguero J
    J Phys Chem A; 2009 Nov; 113(45):12411-20. PubMed ID: 19462958
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Joint theoretical experimental investigation of the electron spin resonance spectra of nitroxyl radicals: application to intermediates in in situ nitroxide mediated polymerization (in situ NMP) of vinyl monomers.
    Zarycz N; Botek E; Champagne B; Sciannaméa V; Jérôme C; Detrembleur C
    J Phys Chem B; 2008 Aug; 112(34):10432-42. PubMed ID: 18680339
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Theoretical calculations of hyperfine coupling constants for muoniated butyl radicals.
    Chen YK; Fleming DG; Wang YA
    J Phys Chem A; 2011 Apr; 115(13):2765-77. PubMed ID: 21395223
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Density functional theory study of 14N isotropic hyperfine coupling constants of organic radicals.
    Hermosilla L; Calle P; Vega JM; Sieiro C
    J Phys Chem A; 2006 Dec; 110(50):13600-8. PubMed ID: 17165888
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Density functional theory predictions of isotropic hyperfine coupling constants.
    Hermosilla L; Calle P; García de la Vega JM; Sieiro C
    J Phys Chem A; 2005 Feb; 109(6):1114-24. PubMed ID: 16833420
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Effect of substituents on spin density in benzimidazole nitronyl nitroxide radicals studied by electron spin resonance.
    Esat B; Fidan I; Bahceci S; Yerli Y; Sari L
    Magn Reson Chem; 2009 Aug; 47(8):641-50. PubMed ID: 19434663
    [TBL] [Abstract][Full Text] [Related]  

  • 12. How accurate is density functional theory in predicting spin density? An insight from the prediction of hyperfine coupling constants.
    Witwicki M; Walencik PK; Jezierska J
    J Mol Model; 2019 Dec; 26(1):10. PubMed ID: 31834497
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Computational studies of EPR parameters for paramagnetic molybdenum complexes. II. Larger MoV systems relevant to molybdenum enzymes.
    Fritscher J; Hrobárik P; Kaupp M
    Inorg Chem; 2007 Oct; 46(20):8146-61. PubMed ID: 17725345
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Theoretical investigation on 1H and 13C NMR chemical shifts of small alkanes and chloroalkanes.
    d'Antuono P; Botek E; Champagne B; Spassova M; Denkova P
    J Chem Phys; 2006 Oct; 125(14):144309. PubMed ID: 17042592
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Fast-flow EPR spectroscopic observation of the isoniazid, iproniazid, and phenylhydrazine hydrazyl radicals.
    Sipe HJ; Jaszewski AR; Mason RP
    Chem Res Toxicol; 2004 Feb; 17(2):226-33. PubMed ID: 14967010
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Assessment of time-dependent density functional schemes for computing the oscillator strengths of benzene, phenol, aniline, and fluorobenzene.
    Miura M; Aoki Y; Champagne B
    J Chem Phys; 2007 Aug; 127(8):084103. PubMed ID: 17764225
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Comparative density-functional study of the electron paramagnetic resonance parameters of amavadin.
    Remenyi C; Munzarova ML; Kaupp M
    J Phys Chem B; 2005 Mar; 109(9):4227-33. PubMed ID: 16851485
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Linewidth analysis of spin labels in liquids. I. Theory and data analysis.
    Robinson BH; Mailer C; Reese AW
    J Magn Reson; 1999 Jun; 138(2):199-209. PubMed ID: 10341123
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Theoretical investigation of paramagnetic diazabutadiene gallium(III)-pnictogen complexes: insights into the interpretation and simulation of electron paramagnetic resonance spectra.
    Tuononen HM; Armstrong AF
    Inorg Chem; 2005 Nov; 44(23):8277-84. PubMed ID: 16270966
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Correlated ab initio spin densities for larger molecules: orbital-optimized spin-component-scaled MP2 method.
    Kossmann S; Neese F
    J Phys Chem A; 2010 Nov; 114(43):11768-81. PubMed ID: 20931951
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 8.