검색결과 : 14건
| No. | Article |
|---|---|
| 1 |
Molecular Interactions of Cephalosporins with the Deep Binding Pocket of the RND Transporter AcrB Atzori A, Malloci G, Prajapati JD, Basciu A, Bosin A, Kleinekathofer U, Dreier J, Vargiu AV, Ruggerone P Journal of Physical Chemistry B, 123(22), 4625, 2019 |
| 2 |
Recognition of Imipenem and Meropenem by the RND-Transporter MexB Studied by Computer Simulations Collu F, Vargiu AV, Dreier J, Cascella M, Ruggerone P Journal of the American Chemical Society, 134(46), 19146, 2012 |
| 3 |
Role of Water during the Extrusion of Substrates by the Efflux Transporter AcrB Schulz R, Vargiu AV, Ruggerone P, Kleinekathofer U Journal of Physical Chemistry B, 115(25), 8278, 2011 |
| 4 |
Role of Water during the Extrusion of Substrates by the Efflux Transporter AcrB (vol 115, pg 8278, 2011) Schulz R, Vargiu AV, Ruggerone P, Kleinekathofer U Journal of Physical Chemistry B, 115(30), 9509, 2011 |
| 5 |
Effect of the F610A Mutation on Substrate Extrusion in the AcrB Transporter: Explanation and Rationale by Molecular Dynamics Simulations Vargiu AV, Collu F, Schulz R, Pos KM, Zacharias M, Kleinekathofer U, Ruggerone P Journal of the American Chemical Society, 133(28), 10704, 2011 |
| 6 |
Molecular Simulations Reveal the Mechanism and the Determinants for Ampicillin Trans location through OmpF Kumar A, Hajjar E, Ruggerone P, Ceccarelli M Journal of Physical Chemistry B, 114(29), 9608, 2010 |
| 7 |
Heme Proteins: The Role of Solvent in the Dynamics of Gates and Portals Scorciapino MA, Robertazzi A, Casu M, Ruggerone P, Ceccarelli M Journal of the American Chemical Society, 132(14), 5156, 2010 |
| 8 |
Copper-1,10-Phenanthroline Complexes Binding to DNA: Structural Predictions from Molecular Simulations Robertazzi A, Vargiu AV, Magistrato A, Ruggerone P, Carloni P, de Hoog P, Reedijk J Journal of Physical Chemistry B, 113(31), 10881, 2009 |
| 9 |
Breathing Motions of a Respiratory Protein Revealed by Molecular Dynamics Simulations Scorciapino MA, Robertazzi A, Casu M, Ruggerone P, Ceccarelli M Journal of the American Chemical Society, 131(33), 11825, 2009 |
| 10 |
The hydrolysis mechanism of the anticancer ruthenium drugs NAMI-A and ICR investigated by DFT-PCM calculations Vargiu AV, Robertazzi A, Magistrato A, Ruggerone P, Carloni P Journal of Physical Chemistry B, 112(14), 4401, 2008 |