Molecular investigation to quantify the translocation of siRNA–NAPA oligomer complexes through lipid membranes
Abstract
Molecular dynamics and umbrella sampling were employed to investigate the translocation of siRNA–NAPA oligomer complexes across a POPC membrane, revealing a high energy barrier (63–95 kcal mol−1) accompanied by significant membrane deformation, underscoring the need for improved carrier design in siRNA therapeutics.

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