Preprint
Sep 2026
Predicting directional flexibility in proteins
This work proposes BackFlip-2: a fast SE(3)-equivariant graph neural network trained to directly predict dynamical descriptors, such as directional backbone flexibility and pairwise dynamic correlations, from an equilibrium structure, and shows that the proposed equivariant architecture is especially well-suited for ca...
Vsevolod Viliuga, Leif Seute, Matteo Tadiello et al.
· 1 citation