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427 related items for PubMed ID: 18046470

  • 1. Circular dichroism and absorption spectroscopy of merocyanine dimer aggregates: molecular properties and exciton transfer dynamics from time-dependent quantum calculations.
    Seibt J, Lohr A, Würthner F, Engel V.
    Phys Chem Chem Phys; 2007 Dec 21; 9(47):6214-8. PubMed ID: 18046470
    [Abstract] [Full Text] [Related]

  • 2. On the calculation of circular dichroism spectra using quantum wave-packet dynamics with an application to molecular dimers.
    Seibt J, Engel V.
    J Chem Phys; 2007 Feb 21; 126(7):074110. PubMed ID: 17328596
    [Abstract] [Full Text] [Related]

  • 3. First-principles calculations of protein circular dichroism in the far-ultraviolet and beyond.
    Oakley MT, Bulheller BM, Hirst JD.
    Chirality; 2006 May 15; 18(5):340-7. PubMed ID: 16557524
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  • 5. Exciton trapping in pi-conjugated materials: a quantum-chemistry-based protocol applied to perylene bisimide dye aggregates.
    Fink RF, Seibt J, Engel V, Renz M, Kaupp M, Lochbrunner S, Zhao HM, Pfister J, Würthner F, Engels B.
    J Am Chem Soc; 2008 Oct 01; 130(39):12858-9. PubMed ID: 18767851
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  • 6. The online assignment of the absolute configuration of natural products: HPLC-CD in combination with quantum chemical CD calculations.
    Bringmann G, Gulder TA, Reichert M, Gulder T.
    Chirality; 2008 May 15; 20(5):628-42. PubMed ID: 18383126
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  • 7. Theory of the absorption and circular dichroism spectra of helical molecular aggregates.
    Eisfeld A, Kniprath R, Briggs JS.
    J Chem Phys; 2007 Mar 14; 126(10):104904. PubMed ID: 17362084
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  • 8. Circular dichroism spectroscopy of small molecular aggregates: dynamical features and size effects.
    Seibt J, Dehm V, Würthner F, Engel V.
    J Chem Phys; 2008 May 28; 128(20):204303. PubMed ID: 18513015
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  • 9. Analysis of the UV/Vis and CD spectral line shapes of carotenoid assemblies: spectral signatures of chiral H-aggregates.
    Spano FC.
    J Am Chem Soc; 2009 Apr 01; 131(12):4267-78. PubMed ID: 19317502
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  • 10. Photochemistry of the water dimer: time-dependent quantum wave-packet description of the dynamics at the S1-S0 conical intersection.
    Chmura B, Lan Z, Rode MF, Sobolewski AL.
    J Chem Phys; 2009 Oct 07; 131(13):134307. PubMed ID: 19814553
    [Abstract] [Full Text] [Related]

  • 11. Simulations of solid-state vibrational circular dichroism spectroscopy of (S)-alternarlactam by using fragmentation quantum chemical calculations.
    Jiang N, Tan RX, Ma J.
    J Phys Chem B; 2011 Mar 31; 115(12):2801-13. PubMed ID: 21391541
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  • 12. DNA as helical ruler: exciton-coupled circular dichroism in DNA conjugates.
    Lewis FD, Zhang L, Liu X, Zuo X, Tiede DM, Long H, Schatz GC.
    J Am Chem Soc; 2005 Oct 19; 127(41):14445-53. PubMed ID: 16218640
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  • 14. Understanding the spectroscopic properties of the photosynthetic reaction center of Rhodobacter sphaeroides by a combined theoretical study of absorption and circular dichroism spectra.
    Ren Y, Ke W, Li Y, Feng L, Wan J, Xu X.
    J Phys Chem B; 2009 Jul 30; 113(30):10055-8. PubMed ID: 19572670
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  • 15. Theoretical analysis of the porphyrin-porphyrin exciton interaction in circular dichroism spectra of dimeric tetraarylporphyrins.
    Pescitelli G, Gabriel S, Wang Y, Fleischhauer J, Woody RW, Berova N.
    J Am Chem Soc; 2003 Jun 25; 125(25):7613-28. PubMed ID: 12812504
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  • 17. Wavelength shifts in solid-state circular dichroism spectra: a possible explanation.
    Castiglioni E, Abbate S, Longhi G, Gangemi R.
    Chirality; 2007 Jun 25; 19(6):491-6. PubMed ID: 17437265
    [Abstract] [Full Text] [Related]

  • 18. Supramolecular stereomutation in kinetic and thermodynamic self-assembly of helical merocyanine dye nanorods.
    Lohr A, Lysetska M, Würthner F.
    Angew Chem Int Ed Engl; 2005 Aug 12; 44(32):5071-4. PubMed ID: 16013073
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  • 19. Circular dichroism and conformational dynamics of cephams and their carba and oxa analogues.
    Frelek J, Kowalska P, Masnyk M, Kazimierski A, Korda A, Woźnica M, Chmielewski M, Furche F.
    Chemistry; 2007 Aug 12; 13(23):6732-44. PubMed ID: 17508378
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