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 *

142 related articles for article (PubMed ID: 16613482)

  • 1. Comment on "Calculation of nuclear magnetic shieldings using an analytically differentiated relativistic shielding formula" [J. Chem. Phys. 123, 114102 (2005)].
    Manninen P; Vaara J
    J Chem Phys; 2006 Apr; 124(13):137101. PubMed ID: 16613482
    [No Abstract]   [Full Text] [Related]  

  • 2. Calculation of nuclear magnetic shieldings using an analytically differentiated relativistic shielding formula.
    Kudo K; Fukui H
    J Chem Phys; 2005 Sep; 123(11):114102. PubMed ID: 16392546
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Relativistic calculation of nuclear magnetic shielding tensor using the regular approximation to the normalized elimination of the small component. II. Consideration of perturbations in the metric operator.
    Maeda H; Ootani Y; Fukui H
    J Chem Phys; 2007 May; 126(17):174102. PubMed ID: 17492852
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Calculation of nuclear magnetic resonance shieldings using frozen-density embedding.
    Jacob CR; Visscher L
    J Chem Phys; 2006 Nov; 125(19):194104. PubMed ID: 17129086
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Four-component relativistic theory for NMR parameters: unified formulation and numerical assessment of different approaches.
    Cheng L; Xiao Y; Liu W
    J Chem Phys; 2009 Apr; 130(14):144102. PubMed ID: 19368424
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Relativistic calculation of nuclear magnetic shielding using normalized elimination of the small component.
    Kudo K; Maeda H; Kawakubo T; Ootani Y; Funaki M; Fukui H
    J Chem Phys; 2006 Jun; 124(22):224106. PubMed ID: 16784262
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Analyzing NMR shielding tensors calculated with two-component relativistic methods using spin-free localized molecular orbitals.
    Autschbach J
    J Chem Phys; 2008 Apr; 128(16):164112. PubMed ID: 18447426
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Relativistic heavy-atom effects on heavy-atom nuclear shieldings.
    Lantto P; Romero RH; Gómez SS; Aucar GA; Vaara J
    J Chem Phys; 2006 Nov; 125(18):184113. PubMed ID: 17115744
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Relativistic theory of nuclear magnetic resonance parameters in a Gaussian basis representation.
    Kutzelnigg W; Liu W
    J Chem Phys; 2009 Jul; 131(4):044129. PubMed ID: 19655859
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Gauge origin independent calculations of nuclear magnetic shieldings in relativistic four-component theory.
    Ilias M; Saue T; Enevoldsen T; Jensen HJ
    J Chem Phys; 2009 Sep; 131(12):124119. PubMed ID: 19791864
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Relativistic calculation of nuclear magnetic shielding tensor including two-electron spin-orbit interactions.
    Ootani Y; Yamaguti H; Maeda H; Fukui H
    J Chem Phys; 2006 Oct; 125(16):164106. PubMed ID: 17092062
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Comment on "Quasirelativistic theory equivalent to fully relativistic theory" [J. Chem. Phys. 123, 241102 (2005)].
    Filatov M
    J Chem Phys; 2006 Sep; 125(10):107101; discussion 107102. PubMed ID: 16999553
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Relativistic calculation of nuclear magnetic shieldings of xenon difluoride.
    Kudo K; Ootani Y; Funaki M; Fukui H
    J Chem Phys; 2006 Mar; 124(11):116101. PubMed ID: 16555919
    [No Abstract]   [Full Text] [Related]  

  • 14. Publisher's note: "Probing the oxygen environment in UO(2)(2+) by solid-state 17O nuclear magnetic resonance spectroscopy and relativistic density functional calculations" [J. Chem. Phys. 132, 084501 (2010)].
    Cho H; de Jong WA; Soderquist CZ
    J Chem Phys; 2010 Mar; 132(10):109901. PubMed ID: 20232988
    [No Abstract]   [Full Text] [Related]  

  • 15. Comment on "New statistical mechanical model for calculating Kirkwood factors in self-associating liquid systems and its application to alkanol+cyclohexane mixtures" [J. Chem. Phys. 127, 114501 (2007)].
    Durov VA
    J Chem Phys; 2009 Jan; 130(4):047101; author reply 047102. PubMed ID: 19191417
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Finite-field implementation of NMR chemical shieldings for molecules: direct and converse gauge-including projector-augmented-wave methods.
    Vasconcelos F; de Wijs GA; Havenith RW; Marsman M; Kresse G
    J Chem Phys; 2013 Jul; 139(1):014109. PubMed ID: 23822295
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Comment on "Postnucleation droplet growth in supersaturated gas with arbitrary vapor concentration" [J. Chem. Phys. 120, 10455 (2004)].
    Vesala T; Kulmala M; Wagner PE
    J Chem Phys; 2004 Oct; 121(16):8163-4. PubMed ID: 15485281
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Comment on "An exact quantum Monte Carlo calculation of the helium-helium intermolecular potential" [J. Chem. Phys. 115, 4546 (2001)].
    Anderson JB
    J Chem Phys; 2004 May; 120(20):9886-7. PubMed ID: 15268005
    [No Abstract]   [Full Text] [Related]  

  • 19. Relativistic calculation of nuclear magnetic shielding tensor using the regular approximation to the normalized elimination of the small component. III. Introduction of gauge-including atomic orbitals and a finite-size nuclear model.
    Hamaya S; Maeda H; Funaki M; Fukui H
    J Chem Phys; 2008 Dec; 129(22):224103. PubMed ID: 19071903
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Comment on "Calculation of the mean first passage time tested on simple two-dimensional models" [J. Chem. Phys. 126, 194708 (2007)].
    Mon KK
    J Chem Phys; 2008 May; 128(19):197102; author reply 197103. PubMed ID: 18500908
    [No Abstract]   [Full Text] [Related]  

    [Next]    [New Search]
    of 8.