Sfoglia per Autore
Insights into Ebola VP35 oligomerization from molecular simulations
2018-01-01 DI PALMA, Francesco; Ramaswamy, VENKATA KRISHNAN; Daino, Gianluca; Frau, Aldo; Corona, Angela; Zinzula, Luca; Tramontano, Enzo; Ruggerone, Paolo; Vargiu, ATTILIO VITTORIO
Chirality Effects on Peptide Self-Assembly Unraveled from Molecules to Materials
2018-01-01 Garcia, A. M.; Iglesias, D.; Parisi, E.; Styan, K. E.; Waddington, L. J.; Deganutti, C.; De Zorzi, R.; Grassi, M.; Melchionna, M.; Vargiu, A. V.; Marchesan, S.
Insights into the homo-oligomerization properties of N-terminal coiled-coil domain of Ebola virus VP35 protein
2018-01-01 Ramaswamy, VENKATA KRISHNAN; DI PALMA, Francesco; Vargiu, Attilio V.; Corona, Angela; Piano, Dario; Ruggerone, Paolo; Zinzula, Luca; Tramontano, Enzo
Computational modelling of efflux pumps and their inhibitors
2017-01-01 Ramaswamy, VENKATA KRISHNAN; Cacciotto, Pierpaolo; Malloci, Giuliano; Vargiu, ATTILIO VITTORIO; Ruggerone, Paolo
Molecular Rationale behind the Differential Substrate Specificity of Bacterial RND Multi-Drug Transporters
2017-01-01 Ramaswamy, VENKATA KRISHNAN; Vargiu, ATTILIO VITTORIO; Malloci, Giuliano; Dreier, Jürg; Ruggerone, Paolo
Multidrug efflux pumps and their inhibitors characterized by computational modeling
2016-01-01 Ramaswamy, VENKATA KRISHNAN; Cacciotto, Pierpaolo; Malloci, Giuliano; Ruggerone, Paolo; Vargiu, ATTILIO VITTORIO
Effect of site-directed mutations in multidrug efflux pump AcrB examined by quantitative efflux assays
2016-01-01 Kinana, Alfred D; Vargiu, ATTILIO VITTORIO; Nikaido, Hiroshi
Aminoacyl β-naphthylamides as substrates and modulators of AcrB multidrug efflux pump
2016-01-01 Kinana, Alfred D.; Vargiu, ATTILIO VITTORIO; May, Thithiwat; Nikaido, Hiroshi
Extracting conformational ensembles of small molecules from molecular dynamics simulations: ampicillin as a test case
2016-01-01 Malloci, Giuliano; Serra, Giovanni; Bosin, Andrea; Vargiu, ATTILIO VITTORIO
Molecular basis for inhibition of AcrB multidrug efflux pump by novel and powerful pyranopyridine derivatives
2016-01-01 Sjuts, Hanno; Vargiu, ATTILIO VITTORIO; Kwasny, Steven M.; Nguyen, Son T.; Kim, Hong Suk; Ding, Xiaoyuan; Ornik, Alina R.; Ruggerone, Paolo; Bowlin, Terry L.; Nikaido, Hiroshi; Pos, Klaas M.; Opperman, Timothy J.
Editorial: Bad bugs in the XXIst century: Resistance mediated by multi-drug efflux pumps in Gram-negative bacteria
2016-01-01 Vargiu, ATTILIO VITTORIO; Pos, Klaas M.; Poole, Keith; Nikaido, Hiroshi
Design of a hydrophobic tripeptide that self-assembles into amphiphilic superstructures forming a hydrogel biomaterial
2016-01-01 Vargiu, ATTILIO VITTORIO; Iglesias, D.; Styan, K. E.; Waddington, L. J.; Easton, C. D.; Marchesan, S.
Higher and lower supramolecular orders for the design of self-assembled heterochiral tripeptide hydrogel biomaterials
2015-01-01 Marchesan, S.; Styan, K. E.; Easton, C. D.; Waddington, L.; Vargiu, ATTILIO VITTORIO
The Phe-Phe motif for peptide self-assembly in nanomedicine
2015-01-01 Marchesan, Silvia; Vargiu, ATTILIO VITTORIO; Styan, Katie E.
AcrB drug-binding pocket substitution confers clinically relevant resistance and altered substrate specificity
2015-01-01 Jessica M. A., Blair; Vassiliy N., Bavro; Vito, Ricci; Niraj, Modi; Pierpaolo, Cacciotto; Ulrich, Kleinekathӧfer; Ruggerone, Paolo; Vargiu, ATTILIO VITTORIO; Alison J., Baylay; Helen E., Smith; Yvonne, Brandon; David, Galloway; Laura J. V., Piddock
Structure-Activity Relationship Study of Hydroxycoumarins and Mushroom Tyrosinase
2015-01-01 Asthana, Shailendra; Zucca, Paolo; Vargiu, ATTILIO VITTORIO; Sanjust, Enrico; Ruggerone, Paolo; Rescigno, Antonio
Computational study of correlated domain motions in the AcrB efflux transporter
2015-01-01 Schulz, R; Vargiu, ATTILIO VITTORIO; Ruggerone, Paolo; Kleinekathöfer, U.
HIV-1 protease dimerization dynamics reveals a transient druggable binding pocket at the interface
2015-01-01 Pietrucci, Fabio; Vargiu, ATTILIO VITTORIO; Kranjc, Agata
A database of force-field parameters, dynamics, and properties of antimicrobial compounds
2015-01-01 Malloci, Giuliano; Vargiu, ATTILIO VITTORIO; Serra, Giovanni; Bosin, Andrea; Ruggerone, Paolo; Ceccarelli, Matteo
Ru[(bpy)(2)(dppz)](2+) and Rh[(bpy)(2)(chrysi)](3+) targeting double strand DNA: the shape of the intercalating ligand tunes the free energy landscape of deintercalation
2014-01-01 Duvan, F; Vargiu, ATTILIO VITTORIO; Magistrato, A.
Titolo | Data di pubblicazione | Autore(i) | Rivista | Editore |
---|---|---|---|---|
Insights into Ebola VP35 oligomerization from molecular simulations | 1-gen-2018 | DI PALMA, Francesco; Ramaswamy, VENKATA KRISHNAN; Daino, Gianluca; Frau, Aldo; Corona, Angela; Zinzula, Luca; Tramontano, Enzo; Ruggerone, Paolo; Vargiu, ATTILIO VITTORIO | ABSTRACTS OF PAPERS - AMERICAN CHEMICAL SOCIETY | AMER CHEMICAL SOC |
Chirality Effects on Peptide Self-Assembly Unraveled from Molecules to Materials | 1-gen-2018 | Garcia, A. M.; Iglesias, D.; Parisi, E.; Styan, K. E.; Waddington, L. J.; Deganutti, C.; De Zorzi, R.; Grassi, M.; Melchionna, M.; Vargiu, A. V.; Marchesan, S. | CHEM | - |
Insights into the homo-oligomerization properties of N-terminal coiled-coil domain of Ebola virus VP35 protein | 1-gen-2018 | Ramaswamy, VENKATA KRISHNAN; DI PALMA, Francesco; Vargiu, Attilio V.; Corona, Angela; Piano, Dario; Ruggerone, Paolo; Zinzula, Luca; Tramontano, Enzo | VIRUS RESEARCH | - |
Computational modelling of efflux pumps and their inhibitors | 1-gen-2017 | Ramaswamy, VENKATA KRISHNAN; Cacciotto, Pierpaolo; Malloci, Giuliano; Vargiu, ATTILIO VITTORIO; Ruggerone, Paolo | ESSAYS IN BIOCHEMISTRY | - |
Molecular Rationale behind the Differential Substrate Specificity of Bacterial RND Multi-Drug Transporters | 1-gen-2017 | Ramaswamy, VENKATA KRISHNAN; Vargiu, ATTILIO VITTORIO; Malloci, Giuliano; Dreier, Jürg; Ruggerone, Paolo | SCIENTIFIC REPORTS | - |
Multidrug efflux pumps and their inhibitors characterized by computational modeling | 1-gen-2016 | Ramaswamy, VENKATA KRISHNAN; Cacciotto, Pierpaolo; Malloci, Giuliano; Ruggerone, Paolo; Vargiu, ATTILIO VITTORIO | - | Springer |
Effect of site-directed mutations in multidrug efflux pump AcrB examined by quantitative efflux assays | 1-gen-2016 | Kinana, Alfred D; Vargiu, ATTILIO VITTORIO; Nikaido, Hiroshi | BIOCHEMICAL AND BIOPHYSICAL RESEARCH COMMUNICATIONS | - |
Aminoacyl β-naphthylamides as substrates and modulators of AcrB multidrug efflux pump | 1-gen-2016 | Kinana, Alfred D.; Vargiu, ATTILIO VITTORIO; May, Thithiwat; Nikaido, Hiroshi | PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA | - |
Extracting conformational ensembles of small molecules from molecular dynamics simulations: ampicillin as a test case | 1-gen-2016 | Malloci, Giuliano; Serra, Giovanni; Bosin, Andrea; Vargiu, ATTILIO VITTORIO | COMPUTATION | - |
Molecular basis for inhibition of AcrB multidrug efflux pump by novel and powerful pyranopyridine derivatives | 1-gen-2016 | Sjuts, Hanno; Vargiu, ATTILIO VITTORIO; Kwasny, Steven M.; Nguyen, Son T.; Kim, Hong Suk; Ding, Xiaoyuan; Ornik, Alina R.; Ruggerone, Paolo; Bowlin, Terry L.; Nikaido, Hiroshi; Pos, Klaas M.; Opperman, Timothy J. | PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA | - |
Editorial: Bad bugs in the XXIst century: Resistance mediated by multi-drug efflux pumps in Gram-negative bacteria | 1-gen-2016 | Vargiu, ATTILIO VITTORIO; Pos, Klaas M.; Poole, Keith; Nikaido, Hiroshi | FRONTIERS IN MICROBIOLOGY | - |
Design of a hydrophobic tripeptide that self-assembles into amphiphilic superstructures forming a hydrogel biomaterial | 1-gen-2016 | Vargiu, ATTILIO VITTORIO; Iglesias, D.; Styan, K. E.; Waddington, L. J.; Easton, C. D.; Marchesan, S. | CHEMICAL COMMUNICATIONS | - |
Higher and lower supramolecular orders for the design of self-assembled heterochiral tripeptide hydrogel biomaterials | 1-gen-2015 | Marchesan, S.; Styan, K. E.; Easton, C. D.; Waddington, L.; Vargiu, ATTILIO VITTORIO | JOURNAL OF MATERIALS CHEMISTRY. B | - |
The Phe-Phe motif for peptide self-assembly in nanomedicine | 1-gen-2015 | Marchesan, Silvia; Vargiu, ATTILIO VITTORIO; Styan, Katie E. | MOLECULES | - |
AcrB drug-binding pocket substitution confers clinically relevant resistance and altered substrate specificity | 1-gen-2015 | Jessica M. A., Blair; Vassiliy N., Bavro; Vito, Ricci; Niraj, Modi; Pierpaolo, Cacciotto; Ulrich, Kleinekathӧfer; Ruggerone, Paolo; Vargiu, ATTILIO VITTORIO; Alison J., Baylay; Helen E., Smith; Yvonne, Brandon; David, Galloway; Laura J. V., Piddock | PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA | - |
Structure-Activity Relationship Study of Hydroxycoumarins and Mushroom Tyrosinase | 1-gen-2015 | Asthana, Shailendra; Zucca, Paolo; Vargiu, ATTILIO VITTORIO; Sanjust, Enrico; Ruggerone, Paolo; Rescigno, Antonio | JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY | - |
Computational study of correlated domain motions in the AcrB efflux transporter | 1-gen-2015 | Schulz, R; Vargiu, ATTILIO VITTORIO; Ruggerone, Paolo; Kleinekathöfer, U. | BIOMED RESEARCH INTERNATIONAL | - |
HIV-1 protease dimerization dynamics reveals a transient druggable binding pocket at the interface | 1-gen-2015 | Pietrucci, Fabio; Vargiu, ATTILIO VITTORIO; Kranjc, Agata | SCIENTIFIC REPORTS | - |
A database of force-field parameters, dynamics, and properties of antimicrobial compounds | 1-gen-2015 | Malloci, Giuliano; Vargiu, ATTILIO VITTORIO; Serra, Giovanni; Bosin, Andrea; Ruggerone, Paolo; Ceccarelli, Matteo | MOLECULES | - |
Ru[(bpy)(2)(dppz)](2+) and Rh[(bpy)(2)(chrysi)](3+) targeting double strand DNA: the shape of the intercalating ligand tunes the free energy landscape of deintercalation | 1-gen-2014 | Duvan, F; Vargiu, ATTILIO VITTORIO; Magistrato, A. | INORGANIC CHEMISTRY | - |
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