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Toward the Prediction of Binding Events in Very Flexible, Allosteric, Multidomain Proteins Basciu, Andrea; Athar, Mohd; Kurt, Han; Neville, Christine; Malloci, Giuliano; Muredda, Fabrizio C.; Bosin, Andrea; Ruggerone, Paolo; Bonvin, Alexandre M. J. J.; Vargiu, Attilio V. Share Save
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Predicting permeation of compounds across the outer membrane of P. aeruginosa using molecular descriptors Manrique, Pedro D.; Leus, Inga V.; Lopez, Cesar A.; Mehla, Jitender; Malloci, Giuliano; Gervasoni, Silvia; Vargiu, Attilio V.; Kinthada, Rama K.; Herndon, Liam; Hengartner, Nicolas W.; Walker, John K.; Rybenkov, Valentin V.; Ruggerone, Paolo; Zgurskaya, Helen I.; Gnanakaran, S. Share Save
Molecular determinants of avoidance and inhibition of Pseudomonas aeruginosa MexB efflux pump Gervasoni, Silvia; Mehla, Jitender; Bergen, Charles R.; Leus, Inga V.; Margiotta, Enrico; Malloci, Giuliano; Bosin, Andrea; Vargiu, Attilio V.; Lomovskaya, Olga; Rybenkov, Valentin V.; Ruggerone, Paolo; Zgurskaya, Helen I. Share Save
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Mechanistic Duality of Bacterial Efflux Substrates and Inhibitors: Example of Simple Substituted Cinnamoyl and Naphthyl Amides D'Cunha, Napoleon; Moniruzzaman, Mohammad; Haynes, Keith; Malloci, Giuliano; Cooper, Connor J.; Margiotta, Enrico; Vargiu, Attilio V.; Uddin, Muhammad R.; Leus, Inga, V; Cao, Feng; Parks, Jerry M.; Rybenkov, Valentin V.; Ruggerone, Paolo; Zgurskaya, Helen, I; Walker, John K. Share Save
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Predictive Rules of Efflux Inhibition and Avoidance in Pseudomonas aeruginosa Mehla, Jitender; Malloci, Giuliano; Mansbach, Rachael; Lopez, Cesar A.; Tsivkovski, Ruslan; Haynes, Keith; Leus, Inga, V; Grindstaff, Sally B.; Cascella, Robert H.; D'Cunha, Napoleon; Herndon, Liam; Hengartner, Nicolas W.; Margiotta, Enrico; Atzori, Alessio; Vargiu, Attilio V.; Manrique, Pedro D.; Walker, John K.; Lomovskaya, Olga; Ruggerone, Paolo; Gnanakaran, S.; Rybenkov, Valentin V.; Zgurskaya, Helen, I Share Save
Perturbed structural dynamics underlie inhibition and altered efflux of the multidrug resistance pump AcrB Reading, Eamonn; Ahdash, Zainab; Fais, Chiara; Ricci, Vito; Xuan Wang-Kan; Grimsey, Elizabeth; Stone, Jack; Malloci, Giuliano; Lau, Andy M.; Findlay, Heather; Konijnenberg, Albert; Booth, Paula J.; Ruggerone, Paolo; Vargiu, Attilio V.; Piddock, Laura J. V.; Politis, Argyris Share Save
Chlorpromazine and Amitriptyline Are Substrates and Inhibitors of the AcrB Multidrug Efflux Pump Grimsey, Elizabeth M.; Fais, Chiara; Marshall, Robert L.; Ricci, Vito; Ciusa, Maria Laura; Stone, Jack W.; Ivens, Alasdair; Malloci, Giuliano; Ruggerone, Paolo; Vargiu, Attilio V.; Piddock, Laura J., V Share Save
Cryo-EM Structure and Molecular Dynamics Analysis of the Fluoroquinolone Resistant Mutant of the AcrB Transporter fromSalmonella Johnson, Rachel M.; Fais, Chiara; Parmar, Mayuriben; Cheruvara, Harish; Marshall, Robert L.; Hesketh, Sophie J.; Feasey, Matthew C.; Ruggerone, Paolo; Vargiu, Attilio V.; Postis, Vincent L. G.; Muench, Stephen P.; Bavro, Vassiliy N. Share Save
The challenge of intracellular antibiotic accumulation, a function of fluoroquinolone influx versus bacterial efflux Vergalli, Julia; Atzori, Alessio; Pajovic, Jelena; Dumont, Estelle; Malloci, Giuliano; Masi, Muriel; Vargiu, Attilio Vittorio; Winterhalter, Mathias; Refregiers, Matthieu; Ruggerone, Paolo; Pages, Jean-Marie Share Save
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