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 *

211 related articles for article (PubMed ID: 23422931)

  • 1. Nuclear magnetic resonance predictions for graphenes: concentric finite models and extrapolation to large systems.
    Vähäkangas J; Ikäläinen S; Lantto P; Vaara J
    Phys Chem Chem Phys; 2013 Apr; 15(13):4634-41. PubMed ID: 23422931
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Characteristic spectral patterns in the carbon-13 nuclear magnetic resonance spectra of hexagonal and crenellated graphene fragments.
    Özcan N; Vähäkangas J; Lantto P; Vaara J
    Chemphyschem; 2014 Jun; 15(9):1799-808. PubMed ID: 24807480
    [TBL] [Abstract][Full Text] [Related]  

  • 3. A first principles theory of nuclear magnetic resonance J-coupling in solid-state systems.
    Joyce SA; Yates JR; Pickard CJ; Mauri F
    J Chem Phys; 2007 Nov; 127(20):204107. PubMed ID: 18052419
    [TBL] [Abstract][Full Text] [Related]  

  • 4. NMR tensors in planar hydrocarbons of increasing size.
    Ikäläinen S; Lantto P; Manninen P; Vaara J
    Phys Chem Chem Phys; 2009 Dec; 11(48):11404-14. PubMed ID: 20024410
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Spin Doublet Point Defects in Graphenes: Predictions for ESR and NMR Spectral Parameters.
    Vähäkangas J; Lantto P; Mareš J; Vaara J
    J Chem Theory Comput; 2015 Aug; 11(8):3746-54. PubMed ID: 26574457
    [TBL] [Abstract][Full Text] [Related]  

  • 6. New perspectives in the PAW/GIPAW approach: J(P-O-Si) coupling constants, antisymmetric parts of shift tensors and NQR predictions.
    Bonhomme C; Gervais C; Coelho C; Pourpoint F; Azaïs T; Bonhomme-Coury L; Babonneau F; Jacob G; Ferrari M; Canet D; Yates JR; Pickard CJ; Joyce SA; Mauri F; Massiot D
    Magn Reson Chem; 2010 Dec; 48 Suppl 1():S86-102. PubMed ID: 20589728
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Unexpected geometrical effects on paramagnetic spin-orbit and spin-dipolar 2J(FF) couplings.
    Ducati LC; Contreras RH; Tormena CF
    J Phys Chem A; 2012 May; 116(20):4930-3. PubMed ID: 22533483
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Theoretical predictions of nuclear magnetic resonance parameters in a novel organo-xenon species: chemical shifts and nuclear quadrupole couplings in HXeCCH.
    Straka M; Lantto P; Räsänen M; Vaara J
    J Chem Phys; 2007 Dec; 127(23):234314. PubMed ID: 18154389
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Fully relativistic calculations of NMR shielding tensors using restricted magnetically balanced basis and gauge including atomic orbitals.
    Komorovský S; Repiský M; Malkina OL; Malkin VG
    J Chem Phys; 2010 Apr; 132(15):154101. PubMed ID: 20423162
    [TBL] [Abstract][Full Text] [Related]  

  • 10. A relativistic DFT methodology for calculating the structures and NMR chemical shifts of octahedral platinum and iridium complexes.
    Vícha J; Patzschke M; Marek R
    Phys Chem Chem Phys; 2013 May; 15(20):7740-54. PubMed ID: 23598437
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Realizing semiconductor-half-metal transition in zigzag graphene nanoribbons supported on hybrid fluorographene-graphane nanoribbons.
    Tang S; Cao X
    Phys Chem Chem Phys; 2014 Nov; 16(42):23214-23. PubMed ID: 25254929
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Solid-state NMR spectra and long intradimer bonds in the pi-[TCNE]22- dianion.
    Strohmeier M; Barich DH; Grant DM; Miller JS; Pugmire RJ; Simons J
    J Phys Chem A; 2006 Jun; 110(25):7962-9. PubMed ID: 16789786
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Structural and electronic properties of fluorographene.
    Samarakoon DK; Chen Z; Nicolas C; Wang XQ
    Small; 2011 Apr; 7(7):965-9. PubMed ID: 21341370
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Density functional study of the 13C NMR chemical shifts in small-to-medium-diameter infinite single-walled carbon nanotubes.
    Zurek E; Pickard CJ; Walczak B; Autschbach J
    J Phys Chem A; 2006 Nov; 110(43):11995-2004. PubMed ID: 17064188
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Comparing quantum-chemical calculation methods for structural investigation of zeolite crystal structures by solid-state NMR spectroscopy.
    Brouwer DH; Moudrakovski IL; Darton RJ; Morris RE
    Magn Reson Chem; 2010 Dec; 48 Suppl 1():S113-21. PubMed ID: 20623826
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Theoretical 13C chemical shift, 14N, and 2H quadrupole coupling- constant studies of hydrogen bonding in L-alanylglycine dipeptide.
    Tafazzoli M; Amini SK
    Magn Reson Chem; 2008 Apr; 46(4):370-6. PubMed ID: 18273875
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Probing local structure in zeolite frameworks: ultrahigh-field NMR measurements and accurate first-principles calculations of zeolite 29Si magnetic shielding tensors.
    Brouwer DH; Enright GD
    J Am Chem Soc; 2008 Mar; 130(10):3095-105. PubMed ID: 18281985
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Application of multinuclear magnetic resonance and gauge-including projector-augmented-wave calculations to the study of solid group 13 chlorides.
    Chapman RP; Bryce DL
    Phys Chem Chem Phys; 2009 Aug; 11(32):6987-98. PubMed ID: 19652833
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Density functional theory investigation of hydrogen bonding effects on the oxygen, nitrogen and hydrogen electric field gradient and chemical shielding tensors of anhydrous chitosan crystalline structure.
    Esrafili MD; Elmi F; Hadipour NL
    J Phys Chem A; 2007 Feb; 111(5):963-70. PubMed ID: 17266238
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Temperature dependence of the (1)J((11)B(19)F) spin-spin coupling in BF(3) molecule.
    Jackowski K; Makulski W; Szyprowska A; Antusek A; Jaszuński M
    Magn Reson Chem; 2009 Oct; 47(10):857-61. PubMed ID: 19637211
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 11.