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Modeling the α-helix to β-hairpin transition mechanism and the formation of oligomeric aggregates of the fibrillogenic peptide A <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si3.gif" overflow="scroll"> <mml:mi>β</mml:mi> </mml:math> (12–28): insights from all-atom molecular dynamics simulations