Crescenzi O - Search Results

1

Conformational analysis of the tyrosine dipeptide analogue in the gas phase and in aqueous solution by a density functional/continuum solvent model.

Langella E, Rega N, Improta R, Crescenzi O, Barone V. Langella E, et al. Among authors: crescenzi o. J Comput Chem. 2002 Apr 30;23(6):650-61. doi: 10.1002/jcc.10065. J Comput Chem. 2002. PMID: 11939597

2

Understanding the role of stereoelectronic effects in determining collagen stability. 2. A quantum mechanical/molecular mechanical study of (Proline-Proline-Glycine)(n) polypeptides.

Improta R, Mele F, Crescenzi O, Benzi C, Barone V. Improta R, et al. Among authors: crescenzi o. J Am Chem Soc. 2002 Jul 3;124(26):7857-65. doi: 10.1021/ja020187p. J Am Chem Soc. 2002. PMID: 12083941

3

Observed and calculated 1H- and 13C-NMR chemical shifts of substituted 5H-pyrido[3,2-a]- and 5H-pyrido[2,3-a]phenoxazin-5-ones and of some 3H-phenoxazin-3-one derivatives.

Crescenzi O, Correale G, Bolognese A, Piscopo V, Parrilli M, Barone V. Crescenzi O, et al. Org Biomol Chem. 2004 Jun 7;2(11):1577-81. doi: 10.1039/b401147c. Epub 2004 Apr 29. Org Biomol Chem. 2004. PMID: 15162207

4

Reliable NMR chemical shifts for molecules in solution by methods rooted in density functional theory.

Benzi C, Crescenzi O, Pavone M, Barone V. Benzi C, et al. Among authors: crescenzi o. Magn Reson Chem. 2004 Oct;42 Spec no:S57-67. doi: 10.1002/mrc.1447. Magn Reson Chem. 2004. PMID: 15366042

5

Oxidative chemistry of 2-nitro and 4-nitroestradiol: Dichotomous behavior of radical intermediates and novel potential routes for oxyfunctionalization and B-ring fission of steroidal scaffolds.

Pezzella A, Manini P, Napolitano A, Crescenzi O, Barone V, d'Ischia M. Pezzella A, et al. Among authors: crescenzi o. Steroids. 2005 Jul;70(8):543-50. doi: 10.1016/j.steroids.2005.01.006. Epub 2005 Mar 29. Steroids. 2005. PMID: 15894039

6

The catecholic antioxidant piceatannol is an effective nitrosation inhibitor via an unusual double bond nitration.

De Lucia M, Panzella L, Crescenzi O, Napolitano A, Barone V, d'Ischia M. De Lucia M, et al. Among authors: crescenzi o. Bioorg Med Chem Lett. 2006 Apr 15;16(8):2238-42. doi: 10.1016/j.bmcl.2006.01.043. Epub 2006 Feb 7. Bioorg Med Chem Lett. 2006. PMID: 16455243

7

Assessing the acid-base and conformational properties of histidine residues in human prion protein (125-228) by means of pK(a) calculations and molecular dynamics simulations.

Langella E, Improta R, Crescenzi O, Barone V. Langella E, et al. Among authors: crescenzi o. Proteins. 2006 Jul 1;64(1):167-77. doi: 10.1002/prot.20979. Proteins. 2006. PMID: 16639746

8

Solvent effects on the UV (n --> pi*) and NMR (13C and 17O) spectra of acetone in aqueous solution. An integrated car-parrinello and DFT/PCM approach.

Crescenzi O, Pavone M, De Angelis F, Barone V. Crescenzi O, et al. J Phys Chem B. 2005 Jan 13;109(1):445-53. doi: 10.1021/jp046334i. J Phys Chem B. 2005. PMID: 16851035

9

Evidence of variable H-bond network for nitroxide radicals in protic solvents.

Pavone M, Sillanpää A, Cimino P, Crescenzi O, Barone V. Pavone M, et al. Among authors: crescenzi o. J Phys Chem B. 2006 Aug 24;110(33):16189-92. doi: 10.1021/jp063872h. J Phys Chem B. 2006. PMID: 16913739

10

Short-lived quinonoid species from 5,6-dihydroxyindole dimers en route to eumelanin polymers: integrated chemical, pulse radiolytic, and quantum mechanical investigation.

Pezzella A, Panzella L, Crescenzi O, Napolitano A, Navaratman S, Edge R, Land EJ, Barone V, d'Ischia M. Pezzella A, et al. Among authors: crescenzi o. J Am Chem Soc. 2006 Dec 6;128(48):15490-8. doi: 10.1021/ja0650246. J Am Chem Soc. 2006. PMID: 17132016

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Article Language

Species

Sex

Age

Other

93 results

Search Page

Filters