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Viviana Palacio‐Betancur

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#graph neural networks Open access Sep 2026

The Graph Fourier Transform Recasts Rouse Modes to Encode Polymer Sequence

Rouse modes diagonalize the polymer connectivity matrix to describe how conformational motion is distributed over structural modes, yet the chemistry distributed along that same chain is traditionally encoded through hand-crafted, system-specific descriptors. Here, we generalize Rouse modes from bead coordinates to bea...

Viviana Palacio‐Betancur, Nicholas E. Jackson · 0 citations

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