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• Equiformer: Equivariant Graph Attention Transformer for 3D Atomistic Graphs
  2022 · 67 citations
• Artificial Intelligence for Science in Quantum, Atomistic, and Continuum Systems
  2023 · 54 citations
• SE(3)-equivariant prediction of molecular wavefunctions and electronic densities
  2021 · 23 citations
• Generative Coarse-Graining of Molecular Conformations
  2022 · 23 citations
• High-performance training and inference for deep equivariant interatomic potentials
  2025 · 11 citations
• Symphony: Symmetry-Equivariant Point-Centered Spherical Harmonics for 3D Molecule Generation
  2023 · 4 citations
• Generalizing Denoising to Non-Equilibrium Structures Improves Equivariant Force Fields
  2024 · 4 citations
• A Recipe for Charge Density Prediction
  2024 · 4 citations
• A General Framework for Equivariant Neural Networks on Reductive Lie Groups
  2023 · 2 citations