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Collegamenti



A Generalized Polarizable Continuum Model For The Study Of Heterogeneous Dielectric Environments (65 visite)

Iozzi MF, Cossi M, Improta R, Rega N, Barone V

Journal Of Chemical Physics, 2006; 124: 1-9.

Tipo di articolo: Journal Article,

Impact factor: 2.028

Impact factor a 5 anni: 1.857


Parole chiave: Non disponibili.

Url: Non disponibile.

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*** IBB - CNR ***
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Contiene: [X]      Estesa  

Autori: [X]   E Tipo di lavoro: [X]

E Data iniziale: Data finale: [X]   E Sede:  E    Affiliazione IBB   [Pulisci modulo]

* A generalized ratiometric chemical exchange saturation transfer (CEST) MRI approach for mapping renal pH using iopamidol (36 visite)
Longo DL, Aime S
Magn Reson Med (ISSN: 1522-2594electronic, 0740-3194linking), 2017 Jul 07; N/D: N/D-N/D.
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* Heterogeneous nucleation helps the search for initial crystallization conditions of γ-glutamyl transpeptidase from Bacillus licheniformis (74 visite)
Lin LL, Merlino A
Communicationsacta Crystallographica Section F Structural Biology And Crystallization (ISSN: 1744-3091, 1744-4309), 2013; 69(6): 669-672.
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* Generalized Formalism Of The Extended Phase Diagram: Theory And Computational Applications (129 visite)
Palma G, Comerci M, Prinster A, Quarantelli M, Alfano B
Italian Chapter Ismrm, 2010 Feb 4; Abstract: N/D-N/D.
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* Generalized Formalism Of The Extended Phase Diagram And Computational Applications Including An Mri Simulator (131 visite) (PDF 109 visite)
Palma G, Comerci M, Prinster A, Quarantelli M, Alfano B
Ismrm Esmrmb Joint Annual Meeting 2010, 2010; N/D: 3287-3287.
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* Toward effective and reliable fluorescence energies in solution by a new state specific polarizable continuum model time dependent density functional theory approach (60 visite)
Improta R, Scalmani G, Frisch MJ, Barone V
J Chem Physj Chem Phys (ISSN: 0021-9606), 2007 Sep 21; 127(7): N/D-N/D.
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* A state-specific polarizable continuum model time dependent density functional theory method for excited state calculations in solution (69 visite)
Improta R, Barone V, Scalmani G, Frisch MJ
J Chem Physj Chem Phys (ISSN: 0021-9606), 2006 Sep 7; 125(5): N/D-N/D.
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* Dissociative electron transfer in donor - Peptide - Acceptor systems: Results for kinetic parameters from a density functional/polarizable continuum model (60 visite)
Barone V, Newton MD, Improta R
J Phys Chem B (ISSN: 1520-6106, 1520-5207, 1520-5207electronic), 2006 Jun 29; 110(25): 12632-12639.
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* A Contribution To The Solvation Free Energy In Isotropic And Anisotropic Polarizable Continuum Model (70 visite)
Benzi C, Cossi M, Improta R, Barone V
Journal Of Computational Chemistry, 2005; 26: 1096-1105.
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* Computation of protein pK's values by an integrated density functional theory/Polarizable Continuum Model approach (76 visite)
Barone V, Improta R, Rega N
Theor Chem Acc (ISSN: 1432-881x), 2004; 111(2-6): 237-245.
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* Absolute pKa determination for carboxylic acids using density functional theory and the polarizable continuum model (96 visite)
Saracino GA, Improta R, Scalmani G, Barone V
Chemical Physics Letters (ISSN: 0009-2614), 2003; 373(3-4): 411-415.
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* Conformational and spectroscopic analysis of the tyrosyl radical dipeptide analogue in the gas phase and in aqueous solution by a density functional/continuum solvent model (60 visite)
Langella E, Improta R, Barone V
J Am Chem Soc (ISSN: 0002-7863, 0002-2786, 1520-5126), 2002 Sep 25; 124(38): 11531-11540.
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* Conformational analysis of the tyrosine dipeptide analogue in the gas phase and in aqueous solution by a density functional/continuum solvent model (71 visite)
Langella E, Rega N, Improta R, Crescenzi O, Barone V
J Comput Chem (ISSN: 0192-8651, 1096-987xelectronic), 2002 Apr 30; 23(6): 650-661.
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12 Records (8 escludendo Abstract e Conferenze).
Impact factor totale: 29.484 (23.274 escludendo Abstract e Conferenze).
Impact factor a 5 anni totale: 36.129 (29.944 escludendo Abstract e Conferenze).

Interrogazione bibliografica effettuata: (([btitle] "Generalized" OR [btitle] "Polarizable" OR [btitle] "Continuum" OR [btitle] "Heterogeneous" OR [btitle] "Dielectric") AND NOT [id] = 9378)







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Ultima modifica di Marco Comerci in data Monday 16 November 2015, 7:34:04
65 visite. Ultima visita in data Tuesday 26 June 2018, 14:14:02

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Ultimo aggiornamento: Wednesday 11 July 2018, 15:28:37