gitlab.com topics: pytorch_geometric
iciq-tcc/nlopez-group/gnn_eads
Code repository for GAME-Net (Graph-based Adsorption on Metal Energy-neural Network), a graph neural network for predicting the adsorption energy of closed-shell molecules on metal surfaces.
Last synced at: almost 2 years ago - Stars: 6 - Forks: 2
cerfacs/elisa
AI tool for solving linear systems and quantifying uncertainties with convolution and graph neural networks
Last synced at: almost 2 years ago - Stars: 0 - Forks: 0
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