megnet

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Himan-D / matgraph-cli

Deep Learning toolkit for Materials Science. Predict properties (CGCNN, MEGNet, M3GNet), discover new materials (GNoME-inspired), simulate XRD, and serve via GraphQL API.

graphql deep-learning gnome pytorch computational-chemistry python-sdk materials-science xrd pymatgen graph-neural-network materials-discovery cgcnn materials-project megnet m3gnet

Updated Aug 14, 2026
Python

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