SJTUer, AI for material science
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Shanghai Jiao Tong University
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Joined
Jun 1, 2025
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MLIPs05 Public
Some useful tools for MLIPS, modeling, sampling, simulation, analysis
Python UpdatedJun 5, 2025 -
DenseGNN Public
Forked from dhw059/DenseGNNDenseGNN: universal and scalable deeper graph neural networks for high-performance property prediction in crystals and molecules
Jupyter Notebook UpdatedJan 3, 2025 -
L-G-DCNN Public
Forked from dhw059/DeepModelFusionL-G-DCNN improves material property predictions with a fusion strategy based on Chemical Environment Classification Vector.
Python GNU General Public License v3.0 UpdatedJul 29, 2024