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: 17552502)

  • 1. TD-DFT investigation of diarylethene dyes with cyclopentene, dihydrothiophene, and dihydropyrrole bridges.
    Perpète EA; Maurel F; Jacquemin D
    J Phys Chem A; 2007 Jun; 111(25):5528-35. PubMed ID: 17552502
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Ab initio tools for the accurate prediction of the visible spectra of anthraquinones.
    Jacquemin D; Wathelet V; Preat J; Perpète EA
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Jun; 67(2):334-41. PubMed ID: 16959534
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Ab initio studies of the lambda(max) of naphthoquinones dyes.
    Perpète EA; Lambert C; Wathelet V; Preat J; Jacquemin D
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Dec; 68(5):1326-33. PubMed ID: 17395529
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Thioindigo dyes: highly accurate visible spectra with TD-DFT.
    Jacquemin D; Preat J; Wathelet V; Fontaine M; Perpète EA
    J Am Chem Soc; 2006 Feb; 128(6):2072-83. PubMed ID: 16464110
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Theoretical study of photochromic compounds. 1. Bond length alternation and absorption spectra for the open and closed forms of 29 diarylethene derivatives.
    Patel PD; Masunov AE
    J Phys Chem A; 2009 Jul; 113(29):8409-14. PubMed ID: 19569671
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Ab initio investigation of the n --> pi* transitions in thiocarbonyl dyes.
    Jacquemin D; Wathelet V; Perpète EA
    J Phys Chem A; 2006 Jul; 110(29):9145-52. PubMed ID: 16854027
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Triplet pathways in diarylethene photochromism: photophysical and computational study of dyads containing ruthenium(II) polypyridine and 1,2-bis(2-methylbenzothiophene-3-yl)maleimide units.
    Indelli MT; Carli S; Ghirotti M; Chiorboli C; Ravaglia M; Garavelli M; Scandola F
    J Am Chem Soc; 2008 Jun; 130(23):7286-99. PubMed ID: 18479107
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Time-dependent density functional theory investigation of the absorption, fluorescence, and phosphorescence spectra of solvated coumarins.
    Jacquemin D; Perpète EA; Scalmani G; Frisch MJ; Assfeld X; Ciofini I; Adamo C
    J Chem Phys; 2006 Oct; 125(16):164324. PubMed ID: 17092090
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Study on photochromism of diarylethenes with a 2,5-dihydropyrrole bridging unit: a convenient preparation of 3,4-diarylpyrroles from 3,4-diaryl-2,5-dihydropyrroles.
    Chen Y; Zeng DX; Xie N; Dang YZ
    J Org Chem; 2005 Jun; 70(13):5001-5. PubMed ID: 15960498
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Excitation spectra of nitro-diphenylaniline: accurate time-dependent density functional theory predictions for charge-transfer dyes.
    Jacquemin D; Bouhy M; Perpète EA
    J Chem Phys; 2006 May; 124(20):204321. PubMed ID: 16774346
    [TBL] [Abstract][Full Text] [Related]  

  • 11. TD-DFT investigation of the UV spectra of pyranone derivatives.
    Preat J; Jacquemin D; Wathelet V; André JM; Perpète EA
    J Phys Chem A; 2006 Jul; 110(26):8144-50. PubMed ID: 16805501
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Synthesis and photochromic properties of functional diarylethene with a 2,5-dihydrothiophene bridging unit.
    Chen Y; Zeng DX; Fan MG
    Org Lett; 2003 May; 5(9):1435-7. PubMed ID: 12713292
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Benchmarks for electronically excited states: time-dependent density functional theory and density functional theory based multireference configuration interaction.
    Silva-Junior MR; Schreiber M; Sauer SP; Thiel W
    J Chem Phys; 2008 Sep; 129(10):104103. PubMed ID: 19044904
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Theoretical investigation of substituted anthraquinone dyes.
    Jacquemin D; Preat J; Charlot M; Wathelet V; André JM; Perpète EA
    J Chem Phys; 2004 Jul; 121(4):1736-43. PubMed ID: 15260723
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Experimental and CIS, TD-DFT, ab initio calculations of visible spectra and the vibrational frequencies of sulfonyl azide-azoic dyes.
    Teimouri A; Chermahini AN; Taban K; Dabbagh HA
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Mar; 72(2):369-77. PubMed ID: 19042151
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Calculation of electronic circular dichroism spectra with time-dependent double-hybrid density functional theory.
    Goerigk L; Grimme S
    J Phys Chem A; 2009 Jan; 113(4):767-76. PubMed ID: 19102628
    [TBL] [Abstract][Full Text] [Related]  

  • 17. TD-DFT simulations of the electronic properties of star-shaped photochromes.
    Jacquemin D; Perpète EA; Maurel F; Perrier A
    Phys Chem Chem Phys; 2010 Jul; 12(28):7994-8000. PubMed ID: 20517564
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Toward a Theoretical Quantitative Estimation of the λmax of Anthraquinones-Based Dyes.
    Perpète EA; Wathelet V; Preat J; Lambert C; Jacquemin D
    J Chem Theory Comput; 2006 Mar; 2(2):434-40. PubMed ID: 26626530
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Time-dependent density functional theory (TDDFT) modelling of Pechmann dyes: from accurate absorption maximum prediction to virtual dye screening.
    Kantchev EA; Norsten TB; Sullivan MB
    Org Biomol Chem; 2012 Sep; 10(33):6682-92. PubMed ID: 22785570
    [TBL] [Abstract][Full Text] [Related]  

  • 20. The photochromism and fluorescence of diarylethenes with a imidazole bridge unit: a strategy for the design of turn-on fluorescent diarylethene system.
    Liu HH; Chen Y
    J Phys Chem A; 2009 May; 113(19):5550-3. PubMed ID: 19385652
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 8.