Main workshop site: http://www.alchemistry.org/wiki/2014_Workshop_on_Free_Energy_Methods_in_Drug_Design
BEDAM trajectory of the TTR peptide binding to the leading edge of the amyloid protofilament. In addition to the canonical β-sheet, the peptide binds in curled-up conformations at both ends. See Fitzpatrick et al PNAS 2013 for an in depth discussion of TTR amyloid fibrils.
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