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EquivariantMultipoleGNN
EquivariantMultipoleGNN PublicForked from rinikerlab/EquivariantMultipoleGNN
Equivariant GNN for the prediction of atomic multipoles up to quadrupoles.
Jupyter Notebook
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directional-mpnn
directional-mpnn PublicForked from zachglick/directional-mpnn
Message Passing Neural Networks for Directional Properties: Fast and Transferable Atomic Multipoles
Python
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goose_local-testing
goose_local-testing PublicForked from aaif-goose/goose
an open source, extensible AI agent that goes beyond code suggestions - install, execute, edit, and test with any LLM
Rust
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cline_local-testing
cline_local-testing PublicForked from cline/cline
Autonomous coding agent right in your IDE, capable of creating/editing files, executing commands, using the browser, and more with your permission every step of the way.
TypeScript
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