Variation of spectral, structural, and vibrational properties within the intrinsically fluorescent proteins family: A density functional study (Articolo in rivista)

Type
Label
  • Variation of spectral, structural, and vibrational properties within the intrinsically fluorescent proteins family: A density functional study (Articolo in rivista) (literal)
Anno
  • 2007-01-01T00:00:00+01:00 (literal)
Alternative label
  • Nifosi, R; Amat, P; Tozzini, V (2007)
    Variation of spectral, structural, and vibrational properties within the intrinsically fluorescent proteins family: A density functional study
    in Journal of computational chemistry
    (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori
  • Nifosi, R; Amat, P; Tozzini, V (literal)
Pagina inizio
  • 2366 (literal)
Pagina fine
  • 2377 (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroVolume
  • 28 (literal)
Rivista
Note
  • ISI Web of Science (WOS) (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#affiliazioni
  • NEST INFM CNR, Scuola Normale Super Pisa, I-56126 Pisa, Italy (literal)
Titolo
  • Variation of spectral, structural, and vibrational properties within the intrinsically fluorescent proteins family: A density functional study (literal)
Abstract
  • We report an extensive (time-dependent) density functional study of the whole series of the chromophores within the Intrinsically Fluorescent Protein family, in the relevant conformations and protonation states. Over 30 structures are considered, including three newly discovered chromophores (zFP, Kaede, and the Orange variant of DsRed). Ab initio, calculations on selected structures are also performed in order to assess the performances of TDDFT along the family. The use of a uniform scheme for all structures allows to establish relationships between the absorption energy and electrostatic, structural or vibrational properties of the chromophores. (c) 2007 Wiley Periodicals, Inc. (literal)
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