kdmsit / crysgnn Star 27 Code Issues Pull requests CrysGNN : Distilling pre-trained knowledge to enhance property prediction for crystalline materials. (AAAI-2023) knowledge-distillation graph-neural-networks crystal-materials gnn-pretraining materials-property-prediction Updated Jul 4, 2023
kdmsit / crysxpp Star 16 Code Issues Pull requests CrysXPP: An Explainable Property Predictor for Crystalline Materials (NPJ Computational Materials - 2022) materials-science graph-neural-networks gnn property-prediction pretraining model-explainability crystal-materials Updated Jul 4, 2023 Python
kdmsit / crysmmnet Star 13 Code Issues Pull requests CrysMMNet: Multimodal Representation for Crystal Property Prediction (UAI-2023) multimodal-learning graph-neural-networks crystal-materials materials-property-prediction Updated Jun 28, 2024 Python