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 *

165 related articles for article (PubMed ID: 15903329)

  • 1. An ab initio valence bond study on cyclopenta-fused naphthalenes and fluoranthenes.
    Havenith RW; van Lenthe JH; Jenneskens LW
    J Org Chem; 2005 May; 70(11):4484-9. PubMed ID: 15903329
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Resonance and aromaticity: an ab initio valence bond approach.
    Rashid Z; van Lenthe JH; Havenith RW
    J Phys Chem A; 2012 May; 116(19):4778-88. PubMed ID: 22559175
    [TBL] [Abstract][Full Text] [Related]  

  • 3. The resonance energy of benzene: a revisit.
    Mo Y
    J Phys Chem A; 2009 Apr; 113(17):5163-9. PubMed ID: 19323538
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Generation of Kekulé valence structures and the corresponding valence bond wave function.
    Rashid Z; van Lenthe JH
    J Comput Chem; 2011 Mar; 32(4):696-708. PubMed ID: 20941739
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Can aromaticity coexist with diradical character? An ab initio valence bond study of S2N2 and related 6π-electron four-membered rings E2N2 and E4(2+) (E=S, Se, Te).
    Braïda B; Lo A; Hiberty PC
    Chemphyschem; 2012 Feb; 13(3):811-9. PubMed ID: 22275164
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Accounting for the differences in the structures and relative energies of the highly homoatomic np pi-np pi (n > or = 3)-bonded S2I4 2+, the Se-I pi-bonded Se2I4 2+, and their higher-energy isomers by AIM, MO, NBO, and VB methodologies.
    Brownridge S; Crawford MJ; Du H; Harcourt RD; Knapp C; Laitinen RS; Passmore J; Rautiainen JM; Suontamo RJ; Valkonen J
    Inorg Chem; 2007 Feb; 46(3):681-99. PubMed ID: 17257010
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Clar's sextet rule is a consequence of the sigma-electron framework.
    Maksić ZB; Barić D; Müller T
    J Phys Chem A; 2006 Aug; 110(33):10135-47. PubMed ID: 16913689
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Aromaticity: an ab initio evaluation of the properly cyclic delocalization energy and the pi-delocalization energy distortivity of benzene.
    Angeli C; Malrieu JP
    J Phys Chem A; 2008 Nov; 112(45):11481-6. PubMed ID: 18925730
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Direct evaluation of cyclic contributions to the pi energy of conjugated hydrocarbons from strongly localized zero-order pictures.
    Malrieu JP; Gicquel M; Fowler PW; Lepetit C; Heully JL; Chauvin R
    J Phys Chem A; 2008 Dec; 112(50):13203-14. PubMed ID: 18817362
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Two-way effects between hydrogen bond and intramolecular resonance effect: an ab initio study on complexes of formamide and its derivatives with water.
    Liu T; Li H; Huang MB; Duan Y; Wang ZX
    J Phys Chem A; 2008 Jun; 112(24):5436-47. PubMed ID: 18503289
    [TBL] [Abstract][Full Text] [Related]  

  • 11. A new look at the ylidic bond in phosphorus ylides and related compounds: energy decomposition analysis combined with a domain-averaged fermi hole analysis.
    Calhorda MJ; Krapp A; Frenking G
    J Phys Chem A; 2007 Apr; 111(15):2859-69. PubMed ID: 17388399
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Molecular mechanics-valence bond method for planar conjugated hydrocarbon cations.
    Hall KF; Tokmachev AM; Bearpark MJ; Boggio-Pasqua M; Robb MA
    J Chem Phys; 2007 Oct; 127(13):134111. PubMed ID: 17919015
    [TBL] [Abstract][Full Text] [Related]  

  • 13. A valence bond study of three-center four-electron pi bonding: electronegativity vs electroneutrality.
    DeBlase A; Licata M; Galbraith JM
    J Phys Chem A; 2008 Dec; 112(50):12806-11. PubMed ID: 18505249
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Modern valence-bond-like representations of selected D6h "aromatic" rings.
    Hill JG; Cooper DL; Karadakov PB
    J Phys Chem A; 2006 Jun; 110(25):7913-7. PubMed ID: 16789780
    [TBL] [Abstract][Full Text] [Related]  

  • 15. The electronic structure of inorganic benzenes: valence bond and ring-current descriptions.
    Engelberts JJ; Havenith RW; van Lenthe JH; Jenneskens LW; Fowler PW
    Inorg Chem; 2005 Jul; 44(15):5266-72. PubMed ID: 16022524
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Wheland intermediates: an ab initio valence bond study.
    Hadzic M; Braïda B; Volatron F
    Org Lett; 2011 Apr; 13(8):1960-3. PubMed ID: 21417309
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Origin of the attraction in aliphatic C-H/pi interactions: infrared spectroscopic and theoretical characterization of gas-phase clusters of aromatics with methane.
    Morita S; Fujii A; Mikami N; Tsuzuki S
    J Phys Chem A; 2006 Sep; 110(36):10583-90. PubMed ID: 16956240
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Partitioning of pi-electrons in rings for Clar structures of benzenoid hydrocarbons.
    Randić M; Balaban AT
    J Chem Inf Model; 2006; 46(1):57-64. PubMed ID: 16426040
    [TBL] [Abstract][Full Text] [Related]  

  • 19. XMVB: a program for ab initio nonorthogonal valence bond computations.
    Song L; Mo Y; Zhang Q; Wu W
    J Comput Chem; 2005 Apr; 26(5):514-21. PubMed ID: 15704237
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Experimental and theoretical study of the photodissociation reaction of thiophenol at 243 nm: intramolecular orbital alignment of the phenylthiyl radical.
    Lim IS; Lim JS; Lee YS; Kim SK
    J Chem Phys; 2007 Jan; 126(3):034306. PubMed ID: 17249870
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.