equivariant-graph-neural-network topic
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equivariant-graph-neural-network repositories
matten
25
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4
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MatTen: Equivariant Graph Neural Nets for Tensorial Properties of Materials
confidence-bootstrapping
16
Stars
1
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Implementation of the Confidence Bootstrapping procedure for protein-ligand docking.
equiformer
177
Stars
34
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[ICLR'23 Spotlight] Equiformer: Equivariant Graph Attention Transformer for 3D Atomistic Graphs
equiformer_v2
153
Stars
21
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[ICLR'24] EquiformerV2: Improved Equivariant Transformer for Scaling to Higher-Degree Representations