Ruggerone P - Search Results

1

Structural and Functional Characterization of a New Double Variant Haemoglobin (HbG-Philadelphia/Duarte α(2)β(2)).

Fais A, Casu M, Ruggerone P, Ceccarelli M, Porcu S, Era B, Anedda R, Sollaino MC, Galanello R, Corda M. Fais A, et al. Among authors: ruggerone p. ISRN Hematol. 2011;2011:735314. doi: 10.5402/2011/735314. Epub 2010 Nov 29. ISRN Hematol. 2011. PMID: 22084702 Free PMC article.

2

Structure-function relationship in a variant hemoglobin: a combined computational-experimental approach.

Ceccarelli M, Ruggerone P, Anedda R, Fais A, Era B, Sollaino MC, Corda M, Casu M. Ceccarelli M, et al. Among authors: ruggerone p. Biophys J. 2006 Nov 1;91(9):3529-41. doi: 10.1529/biophysj.106.083170. Epub 2006 Jul 14. Biophys J. 2006. PMID: 16844744 Free PMC article.

3

CO escape from myoglobin with metadynamics simulations.

Ceccarelli M, Anedda R, Casu M, Ruggerone P. Ceccarelli M, et al. Among authors: ruggerone p. Proteins. 2008 May 15;71(3):1231-6. doi: 10.1002/prot.21817. Proteins. 2008. PMID: 18041761

4

Physical insights into permeation of and resistance to antibiotics in bacteria.

Ceccarelli M, Ruggerone P. Ceccarelli M, et al. Among authors: ruggerone p. Curr Drug Targets. 2008 Sep;9(9):779-88. doi: 10.2174/138945008785747770. Curr Drug Targets. 2008. PMID: 18781923 Review.

5

Evidences of xenon-induced structural changes in the active site of cyano-metmyoglobins: a 1H NMR study.

Anedda R, Era B, Casu M, Fais A, Ceccarelli M, Corda M, Ruggerone P. Anedda R, et al. Among authors: ruggerone p. J Phys Chem B. 2008 Dec 11;112(49):15856-66. doi: 10.1021/jp807959u. J Phys Chem B. 2008. PMID: 19368018

6

Breathing motions of a respiratory protein revealed by molecular dynamics simulations.

Scorciapino MA, Robertazzi A, Casu M, Ruggerone P, Ceccarelli M. Scorciapino MA, et al. Among authors: ruggerone p. J Am Chem Soc. 2009 Aug 26;131(33):11825-32. doi: 10.1021/ja9028473. J Am Chem Soc. 2009. PMID: 19653680

7

Heme proteins: the role of solvent in the dynamics of gates and portals.

Scorciapino MA, Robertazzi A, Casu M, Ruggerone P, Ceccarelli M. Scorciapino MA, et al. Among authors: ruggerone p. J Am Chem Soc. 2010 Apr 14;132(14):5156-63. doi: 10.1021/ja909822d. J Am Chem Soc. 2010. PMID: 20095556

8

Bridging timescales and length scales: from macroscopic flux to the molecular mechanism of antibiotic diffusion through porins.

Hajjar E, Mahendran KR, Kumar A, Bessonov A, Petrescu M, Weingart H, Ruggerone P, Winterhalter M, Ceccarelli M. Hajjar E, et al. Among authors: ruggerone p. Biophys J. 2010 Feb 17;98(4):569-75. doi: 10.1016/j.bpj.2009.10.045. Biophys J. 2010. PMID: 20159153 Free PMC article.

9

Investigating reaction pathways in rare events simulations of antibiotics diffusion through protein channels.

Hajjar E, Kumar A, Ruggerone P, Ceccarelli M. Hajjar E, et al. Among authors: ruggerone p. J Mol Model. 2010 Nov;16(11):1701-8. doi: 10.1007/s00894-010-0698-4. J Mol Model. 2010. PMID: 20393764

10

Molecular simulations reveal the mechanism and the determinants for ampicillin translocation through OmpF.

Kumar A, Hajjar E, Ruggerone P, Ceccarelli M. Kumar A, et al. Among authors: ruggerone p. J Phys Chem B. 2010 Jul 29;114(29):9608-16. doi: 10.1021/jp9110579. J Phys Chem B. 2010. PMID: 20590090

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