Search Results - "Malvacio, Ivana"
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Water-mediated interactions enable smooth substrate transport in a bacterial efflux pump
Published in Biochimica et biophysica acta. General subjects (01-04-2018)“…Efflux pumps of the Resistance-Nodulation-cell Division superfamily confer multi-drug resistance to Gram-negative bacteria. The most-studied polyspecific…”
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DockBench: An Integrated Informatic Platform Bridging the Gap between the Robust Validation of Docking Protocols and Virtual Screening Simulations
Published in Molecules (Basel, Switzerland) (29-05-2015)“…Virtual screening (VS) is a computational methodology that streamlines the drug discovery process by reducing costs and required resources through the in…”
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Synthesis and preliminary structure-activity relationship study of 2-aryl-2H-pyrazolo[4,3-c]quinolin-3-ones as potential checkpoint kinase 1 (Chk1) inhibitors
Published in Journal of enzyme inhibition and medicinal chemistry (01-01-2018)“…The serine-threonine checkpoint kinase 1 (Chk1) plays a critical role in the cell cycle arrest in response to DNA damage. In the last decade, Chk1 inhibitors…”
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Computer simulations of the activity of RND efflux pumps
Published in Research in microbiology (01-09-2018)“…The putative mechanism by which bacterial RND-type multidrug efflux pumps recognize and transport their substrates is a complex and fascinating enigma of…”
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Molecular Insights on the Recognition of Substrates by the Promiscuous Efflux Pump AcrB
Published in Biophysical journal (03-02-2017)Get full text
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Molecular basis for the different interactions of congeneric substrates with the polyspecific transporter AcrB
Published in Biochimica et biophysica acta. Biomembranes (01-07-2019)“…The drug/proton antiporter AcrB, which is part of the major efflux pump AcrABZ-TolC in Escherichia coli, is the paradigm transporter of the…”
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A new plant-based drug delivery platform based on alkyl polyglucosides and β-sitosterol nanovesicles for topical delivery
Published in Applied materials today (01-12-2024)“…•Novel nanovesicles without animal-derived components have been developed.•These stable nanovesicles are formed by the self-assembly of β-sitosterol, lauryl…”
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