Home Research Locations About us Organization Staff Contacts Education Login Documents IT
Projects highlights

INCIPIT

ISTAPCA (836 views)

Euro-BioImaging

Instruct-IT

Fondazione Veronesi

Fondo Europeo Pesca (248 views)

 INMiND (912 views)

 PRIN (1016 views)

 eHealthNet (839 views)

  Ponrec (794 views)

MFAG Grant (862 views)


Links

 |<  < >  >| 

    Export to BibTeX    Export to EndNote

Quantum dynamics of ultrafast photoinduced processes in biological molecules (37 views)

Santoro F, Barone V, Improta R, Lami A, Olivucci M

Aip Conf Proc (ISSN: 0094-243x), 2007; 963(2): 667-670.

Abstract
We present different examples where a quantum dynamical approach to photoinduced processes can reveal features and give answers not available only on the ground of static computations of the potential energy surfaces (PES). We face with different processes of great biological relevance and namely the retinal photoisomerization and the internal conversion in monomers and dimers of DNA nucleobases. Depending on the case, we compute dynamics on a single or on coupled excited electronic states, with PES obtained by first-principle calculations or provided by model Hamiltonians. © 2007 American Institute of Physics.

Affiliations ▼
*** IBB - CNR Affiliation

Istituto per i Processi Chimico-Fisici del CNR, Area della Ricerca del CNR, Via G. Moruzzi 1, 56124 Pisa, Italy

Dipartimento di Chimica, Università Federico II di Napoli, Complesso Universitario Monte S. Angelo, Via Cintia, 11, 80126 Napoli, Italy

Istituto di Biostrutture eBioimmagini del CNR, Via Mezzocannone 6, 80134 Napoli, Italy

Centro per lo Studio dei Sistemi Complessi, Via Tommaso Pendola 37, I-53100 Siena, Italy

Details ▼
Impact factor: 0, 5-year impact factor: 0

Paper type: Journal Article,

Keywords: 5fluoro-Uracil, Adenite Dimers, Nonadiabatic Quantum Dynamics, Nonradiative Transitions, Photodeactivation, Photoisomerization, Retinal,

Url: http://www.scopus.com/inward/record.url?eid=2-s2.0-71449124601&partnerID=40&md5=5e3117a01f05937068ed02e85dd27311

References ▼
Kosloff, R., (1996) Dynamics of Molecules and Chemical Reactions, , edited by R. E. Wyatt and J. Z. H. Zhang, Marcel Dekker, Inc, New Yor

Beck, H., Jäckle, A., Worth, G., Meyer, H.-D., (2000) Phys. Rep, 324, p. 1

Frutos, L.M., Andriunóv, T., Santoro, F., Ferré, N., Olivucci, M., (2007) Proc Natl. Acad. of Science, 104, p. 7764. , USA

Olivucci, M., Lami, A., Santoro, F., (2005) Ang. Chem, 44, p. 5118. , Int. Ed

Logunov, S.L., Song, L., El-Sayed, M.A., (1996) J. Phys. Chem, 100, p. 18586

Kandori, H., Furatani, Y., Nishimura, S., Shichida, Y., Chosrowjan, H., Shibata, Y., Malaga, N., (2001) Chem. Phys. Lett, 334, p. 271

Santoro, F., Lami, A., Olivucci, M., (2007) Theor. Chem. Acc, 117, p. 1061

Crespo-Hernández, C.E., Cohen, B., Hare, P.M., Kohler, B., (2004) Chem. Rev, 104, p. 1977

Markovitsi, D., Talbot, F., Gustavvson, T., Onidas, D., Lazzaretto, E., (2005) J. Am. Chem. Soc, 127, p. 17130

Serrano-Andrés, L., Merchán, M., Borin, A.C., (2006) Proc Natl. Acad. of Science, 103, p. 8691. , USA

Matsika, S., (2005) J. Phys. Chem. A, 105, p. 7538

Santoro, F., Barone, V., Gustavsson, T., Improta, R., (2006) J. Am. Chem. Soc, 128, p. 16312

ibidem 441, E8.3 (2006)Markovitsi, D., Talbot, F., Gustavvson, T., Onidas, D., Lazzaretto, E., Marguet, S., (2006) Nature, 441, pp. E7

Kwok, W.-M., Phillips, D.L., (2006) J. Am. Chem. Soc, 128, p. 11894

Hare, P.M., Crespo-Hernández, C.E., Kohler, B., (2007) Proc. Natl. Acad. Science, USA, 104, p. 435

A4 - Eur. Soc. Comput. Methods Sci. Eng. ESCMSE

Ministry of National Education and Religious Affairs

E4 Computer Engineering


Related activities ▼
No results.

Related papers ▼
No results.

Related bibliography ▼

Content: [X]
Extended

Authors: [X]
AND Paper type: [X]

AND Start date: End date: [X]   AND Site:    AND  IBB affiliation

[Clear form]

<=2001 2002 2003 2004 2005 2006 2007 2008 2009 2010 2011 2012 2013 2014 2015 2016 2017   ALL YEARS

Sort by: date    title    journal    authors      impact factor

* Time-Dependent and Time-Independent Approaches for the Computation of Absorption Spectra of Uracil Derivatives in Solution (39 views)
Improta R, Lami A, Barone V SF
International Journal Of Quantum Chemistry (ISSN: 0020-7608), 2010 Mar 5; 110(3): 624-636.

View    Export to BibTeX    Export to EndNote    Upload PDF


1 Records (1 excluding Abstracts and Conferences).
Total impact factor: 1.166 (1.166 excluding Abstracts and Conferences).
Total 5-year impact factor: 1.167 (1.167 excluding Abstracts and Conferences).



Your bibliography query: (([btitle, keywords, abstract] 5FLUORO AND [btitle, keywords, abstract] URACIL)) AND NOT [id] = 52347



Last modified by Marco Comerci on Thursday 19 March 2015, 16:43:15
37 views. Last viewed on Thursday 14 September 2017, 12:46:16


Webmaster and developer: Marco Comerci
For problems and suggestions: adminibb.cnr.it
Last updated: Wednesday 20 September 2017, 10:43:29