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Pyxtal gnn proxy#249

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carriepl wants to merge 6 commits intoccrystalalexhernandezgarcia/gflownet:ccrystalfrom pyxtal_gnn_proxyalexhernandezgarcia/gflownet:pyxtal_gnn_proxyCopy head branch name to clipboard

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Commits on Oct 25, 2023

• Add proxy config file for phast proxy

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Commits on Oct 31, 2023

• Add initial proxy with phast and pyxtal

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  4a476cb

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• Fix validation of the lattice angles

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• Parse pyxtal crystals to graph for the GNN

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Commits on Nov 20, 2023

• Ensure installation of OCP repo

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Commits on Nov 24, 2023

• fixup

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