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 *

189 related articles for article (PubMed ID: 15839725)

  • 1. A first principles calculations and experimental study of the ground- and excited-state properties of ladder oligo(p-aniline)s.
    Belletête M; Durocher G; Hamel S; Côte M; Wakim S; Leclerc M
    J Chem Phys; 2005 Mar; 122(10):104303. PubMed ID: 15839725
    [TBL] [Abstract][Full Text] [Related]  

  • 2. A theoretical, spectroscopic, and photophysical study of 2,7-carbazolenevinylene-based conjugated derivatives.
    Belletête M; Morin JF; Leclerc M; Durocher G
    J Phys Chem A; 2005 Aug; 109(31):6953-9. PubMed ID: 16834054
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Optical and photophysical properties of indolocarbazole derivatives.
    Belletête M; Blouin N; Boudreault PL; Leclerc M; Durocher G
    J Phys Chem A; 2006 Dec; 110(51):13696-704. PubMed ID: 17181323
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Influence of molecular geometry, exchange-correlation functional, and solvent effects in the modeling of vertical excitation energies in phthalocyanines using time-dependent density functional theory (TDDFT) and polarized continuum model TDDFT methods: can modern computational chemistry methods explain experimental controversies?
    Nemykin VN; Hadt RG; Belosludov RV; Mizuseki H; Kawazoe Y
    J Phys Chem A; 2007 Dec; 111(50):12901-13. PubMed ID: 18004829
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Study of electronic and spectroscopic properties on a newly synthesized red fluorescent material.
    Liu X; Ju H; Zhao X; Tao X; Bian W; Jiang M
    J Chem Phys; 2006 May; 124(17):174711. PubMed ID: 16689594
    [TBL] [Abstract][Full Text] [Related]  

  • 6. A density functional theory (DFT) and time-dependent density functional theory (TDDFT) study on optical transitions in oligo(p-phenylenevinylene)-fullerene dyads and the applicability to resonant energy transfer.
    Toivonen TL; Hukka TI
    J Phys Chem A; 2007 Jun; 111(22):4821-8. PubMed ID: 17477511
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Semiempirical PM5 molecular orbital study on chlorophylls and bacteriochlorophylls: comparison of semiempirical, ab initio, and density functional results.
    Linnanto J; Korppi-Tommola J
    J Comput Chem; 2004 Jan; 25(1):123-38. PubMed ID: 14635000
    [TBL] [Abstract][Full Text] [Related]  

  • 8. First- and second-order polarizabilities of simple merocyanines. An experimental and theoretical reassessment of the two-level model.
    Momicchioli F; Ponterini G; Vanossi D
    J Phys Chem A; 2008 Nov; 112(46):11861-72. PubMed ID: 18942806
    [TBL] [Abstract][Full Text] [Related]  

  • 9. On the ordering of the first two excited electronic states in all-trans linear polyenes.
    Catalán J; de Paz JL
    J Chem Phys; 2004 Jan; 120(4):1864-72. PubMed ID: 15268319
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Optical properties and delocalization of excess negative charges on oligo(phenylenevinylene)s: a quantum chemical study.
    Fratiloiu S; Grozema FC; Siebbeles LD
    J Phys Chem B; 2005 Mar; 109(12):5644-52. PubMed ID: 16851609
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Theoretical study of vibrational and optical spectra of methylene-bridged oligofluorenes.
    Lukes V; Aquino A; Lischka H
    J Phys Chem A; 2005 Nov; 109(45):10232-8. PubMed ID: 16833316
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Electronic transitions involved in the absorption spectrum and dual luminescence of tetranuclear cubane [Cu4I4(pyridine)4] cluster: a density functional theory/time-dependent density functional theory investigation.
    De Angelis F; Fantacci S; Sgamellotti A; Cariati E; Ugo R; Ford PC
    Inorg Chem; 2006 Dec; 45(26):10576-84. PubMed ID: 17173412
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Density functional calculations of the vibronic structure of electronic absorption spectra.
    Dierksen M; Grimme S
    J Chem Phys; 2004 Feb; 120(8):3544-54. PubMed ID: 15268516
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Excited state proton transfer in guanine in the gas phase and in water solution: a theoretical study.
    Shukla MK; Leszczynski J
    J Phys Chem A; 2005 Sep; 109(34):7775-80. PubMed ID: 16834154
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Vibronic effects in the 1(1)B(u)(1(1)B(2)) excited singlet states of oligothiophenes. fluorescence study of the 1(1)A(g)(1(1)A(1)) <-- 1(1)B(u)(1(1)B(2)) transition in terms of DFT, TDDFT, and CASSCF methods.
    Andrzejak M; Pawlikowski MT
    J Phys Chem A; 2008 Dec; 112(51):13737-44. PubMed ID: 19053502
    [TBL] [Abstract][Full Text] [Related]  

  • 16. A computational study of the ground and excited state structure and absorption spectra of free-base N-confused porphine and free-base N-confused tetraphenylporphyrin.
    Vyas S; Hadad CM; Modarelli DA
    J Phys Chem A; 2008 Jul; 112(29):6533-49. PubMed ID: 18593108
    [TBL] [Abstract][Full Text] [Related]  

  • 17. TDDFT investigation on nucleic acid bases: comparison with experiments and standard approach.
    Shukla MK; Leszczynski J
    J Comput Chem; 2004 Apr; 25(5):768-78. PubMed ID: 14978720
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Theoretical study on the singlet excited state of pterin and its deactivation pathway.
    Chen X; Xu X; Cao Z
    J Phys Chem A; 2007 Sep; 111(38):9255-62. PubMed ID: 17629256
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Ab initio and semiempirical study of structure and electronic spectra of hydroxy substituted naphthoquinones.
    Khan MS; Khan ZH
    Spectrochim Acta A Mol Biomol Spectrosc; 2005 Feb; 61(4):777-90. PubMed ID: 15649814
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Theoretical investigations on the electronic and optical properties of bridged oligothiophenes.
    Bouzzine SM; Hamidi M; Bouachrine M; Serien-Spirau F; Lère Porte JP; Sotiropoulos JM; Iraqi A
    J Phys Chem A; 2012 Oct; 116(39):9730-8. PubMed ID: 22954252
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 10.