Masetti M - Search Results

1

Kinetic and thermochemical study of the antioxidant activity of sulfur-containing analogues of vitamin E.

Amorati R, Cavalli A, Fumo MG, Masetti M, Menichetti S, Pagliuca C, Pedulli GF, Viglianisi C. Amorati R, et al. Among authors: masetti m. Chemistry. 2007;13(29):8223-30. doi: 10.1002/chem.200700309. Chemistry. 2007. PMID: 17636469

2

QT prolongation through hERG K(+) channel blockade: current knowledge and strategies for the early prediction during drug development.

Recanatini M, Poluzzi E, Masetti M, Cavalli A, De Ponti F. Recanatini M, et al. Among authors: masetti m. Med Res Rev. 2005 Mar;25(2):133-66. doi: 10.1002/med.20019. Med Res Rev. 2005. PMID: 15389727 Review.

3

In silico modelling--pharmacophores and hERG channel models.

Recanatini M, Cavalli A, Masetti M. Recanatini M, et al. Among authors: masetti m. Novartis Found Symp. 2005;266:171-81; discussion 181-5. Novartis Found Symp. 2005. PMID: 16050268 Review.

4

Three-dimensional model of the human aromatase enzyme and density functional parameterization of the iron-containing protoporphyrin IX for a molecular dynamics study of heme-cysteinato cytochromes.

Favia AD, Cavalli A, Masetti M, Carotti A, Recanatini M. Favia AD, et al. Among authors: masetti m. Proteins. 2006 Mar 1;62(4):1074-87. doi: 10.1002/prot.20829. Proteins. 2006. PMID: 16395678

5

Density functional studies on the Nazarov reaction involving cyclic systems.

Cavalli A, Masetti M, Recanatini M, Prandi C, Guarna A, Occhiato EG. Cavalli A, et al. Among authors: masetti m. Chemistry. 2006 Mar 20;12(10):2836-45. doi: 10.1002/chem.200501391. Chemistry. 2006. PMID: 16429476

6

Modeling the hERG potassium channel in a phospholipid bilayer: Molecular dynamics and drug docking studies.

Masetti M, Cavalli A, Recanatini M. Masetti M, et al. J Comput Chem. 2008 Apr 15;29(5):795-808. doi: 10.1002/jcc.20842. J Comput Chem. 2008. PMID: 17926340

7

Modeling HERG and its interactions with drugs: recent advances in light of current potassium channel simulations.

Recanatini M, Cavalli A, Masetti M. Recanatini M, et al. Among authors: masetti m. ChemMedChem. 2008 Apr;3(4):523-35. doi: 10.1002/cmdc.200700264. ChemMedChem. 2008. PMID: 18224703 Review.

8

Exploring complex protein-ligand recognition mechanisms with coarse metadynamics.

Masetti M, Cavalli A, Recanatini M, Gervasio FL. Masetti M, et al. J Phys Chem B. 2009 Apr 9;113(14):4807-16. doi: 10.1021/jp803936q. J Phys Chem B. 2009. PMID: 19298042

9

Covalent inhibitors of fatty acid amide hydrolase: a rationale for the activity of piperidine and piperazine aryl ureas.

Palermo G, Branduardi D, Masetti M, Lodola A, Mor M, Piomelli D, Cavalli A, De Vivo M. Palermo G, et al. Among authors: masetti m. J Med Chem. 2011 Oct 13;54(19):6612-23. doi: 10.1021/jm2004283. Epub 2011 Sep 8. J Med Chem. 2011. PMID: 21830831 Free PMC article.

10

Substrate binding process and mechanistic functioning of type 1 11β-hydroxysteroid dehydrogenase from enhanced sampling methods.

Favia AD, Masetti M, Recanatini M, Cavalli A. Favia AD, et al. Among authors: masetti m. PLoS One. 2011;6(9):e25375. doi: 10.1371/journal.pone.0025375. Epub 2011 Sep 23. PLoS One. 2011. PMID: 21966510 Free PMC article.

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