Berberine binding to telomeric Gquadruplex DNA

############################# Video Source: www.youtube.com/watch?v=HI_FYC_CQS0

The peculiar binding mechanism of Berberine to human telomeric G-quadruplex is disclosed with funnel-metadynamics calculations (Limongelli and co. PNAS 2017,...

metadynamics, funnel-metadynamics, berberin, ligand binding, DNA, G-quadruplex, telomere, binding free energy, enhanced sampling, molecular dynamics
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