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Ai Protein Structure Prediction

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Ai Protein Structure Prediction

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Research Frontiers in Equivariant Neural Networks for 3D Geometry

Design of SE(3)-equivariant and rotation-invariant neural networks that respect three-dimensional geometric constraints in protein structure prediction.

Symmetry-Preserving Learning in Folded Protein Landscapes
Equivariant Representations of Protein Dynamics and Conformational Space
Group-Theoretic Constraints on Neural Prediction of Tertiary Structure
Geometric Deep Learning for Protein-Ligand Binding Topology
Rotational Invariance in Backbone Angle Prediction Networks
Equivariant Message Passing Across Heterogeneous Protein Architectures
Symmetry Breaking and Loss of Prediction Fidelity in SE(3) Models
Manifold Learning of Protein Conformational Ensembles via Equivariance
Geometric Constraints for Coarse-Grained Protein Structure Networks
Translation and Rotation Equivariance in Multi-Chain Complex Prediction

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