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Ligand binding to telomeric G-quadruplex DNA investigated by funnel-metadynamics simulations

G-quadruplexes (G4s) are higher-order DNA structures typically present at promoter regions of genes and telomeres. Here, the G4 formation decreases the replicative DNA at each cell cycle, finally leading to apoptosis. The ability to control this mitotic clock, particularly in cancer cells, is fascin...

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Bibliografiske detaljer
Udgivet i:Proc Natl Acad Sci U S A
Main Authors: Moraca, Federica, Amato, Jussara, Ortuso, Francesco, Artese, Anna, Pagano, Bruno, Novellino, Ettore, Alcaro, Stefano, Parrinello, Michele, Limongelli, Vittorio
Format: Artigo
Sprog:Inglês
Udgivet: National Academy of Sciences 2017
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Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC5358390/
https://ncbi.nlm.nih.gov/pubmed/28232513
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1612627114
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