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Journal Abstract Search

345 related items for PubMed ID: 19725512

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  • 3. Force field optimization using dynamics and ensemble averaged data: vibrational spectra and relaxation in bound MbCO.
    Devereux M, Meuwly M.
    J Chem Inf Model; 2010 Mar 22; 50(3):349-57. PubMed ID: 20146509
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  • 4. Single-atom test of all-atom empirical potentials: Fe in myoglobin.
    Rai BK, Prohofsky EW, Durbin SM.
    J Phys Chem B; 2005 Oct 13; 109(40):18983-7. PubMed ID: 16853444
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  • 5. Vibrational spectroscopy of protonated imidazole and its complexes with water molecules: ab initio anharmonic calculations and experiments.
    Adesokan AA, Chaban GM, Dopfer O, Gerber RB.
    J Phys Chem A; 2007 Aug 09; 111(31):7374-81. PubMed ID: 17500546
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  • 6. Vibrational spectroscopy of the G...C base pair: experiment, harmonic and anharmonic calculations, and the nature of the anharmonic couplings.
    Brauer B, Gerber RB, Kabelác M, Hobza P, Bakker JM, Abo Riziq AG, de Vries MS.
    J Phys Chem A; 2005 Aug 11; 109(31):6974-84. PubMed ID: 16834057
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  • 8. Langevin model of the temperature and hydration dependence of protein vibrational dynamics.
    Moritsugu K, Smith JC.
    J Phys Chem B; 2005 Jun 23; 109(24):12182-94. PubMed ID: 16852503
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  • 9. Time-resolved resonance Raman study on ultrafast structural relaxation and vibrational cooling of photodissociated carbonmonoxy myoglobin.
    Kitagawa T, Haruta N, Mizutani Y.
    Biopolymers; 2002 Jun 23; 67(4-5):207-13. PubMed ID: 12012433
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  • 10. Computational vibrational spectroscopy of peptides and proteins in one and two dimensions.
    Jeon J, Yang S, Choi JH, Cho M.
    Acc Chem Res; 2009 Sep 15; 42(9):1280-9. PubMed ID: 19456096
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  • 15. Molecular dynamics simulations and instantaneous normal-mode analysis of the vibrational relaxation of the C-H stretching modes of N-methylacetamide-d in liquid deuterated water.
    Bastida A, Soler MA, Zúñiga J, Requena A, Kalstein A, Fernández-Alberti S.
    J Phys Chem A; 2010 Nov 04; 114(43):11450-61. PubMed ID: 20932051
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  • 16. Global mapping of structural solutions provided by the extended X-ray absorption fine structure ab initio code FEFF 6.01: structure of the cryogenic photoproduct of the myoglobin-carbon monoxide complex.
    Chance MR, Miller LM, Fischetti RF, Scheuring E, Huang WX, Sclavi B, Hai Y, Sullivan M.
    Biochemistry; 1996 Jul 16; 35(28):9014-23. PubMed ID: 8703904
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  • 18. Anharmonic effects in IR, Raman, and Raman optical activity spectra of alanine and proline zwitterions.
    Danecek P, Kapitán J, Baumruk V, Bednárová L, Kopecký V, Bour P.
    J Chem Phys; 2007 Jun 14; 126(22):224513. PubMed ID: 17581069
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