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    • MolSets

      Public
      Molecular graph deep sets learning for mixture property modeling.
      Python
      MIT License
      3000Updated Dec 13, 2024Dec 13, 2024
    • This repository contains the LVGP-MOBBO code used in the Rapid Design of Top Performing Metal-Organic Frameworks with Qualitative Representations of Building Blocks paper.
      MATLAB
      1500Updated Jan 26, 2024Jan 26, 2024
    • Multiview opinion fusion machine learning (MvOF-ML) for automatically identifying crystal systems from electron diffraction patterns.
      Python
      MIT License
      0000Updated Jan 2, 2024Jan 2, 2024
    • ET-AL

      Public
      Entropy-targeted active learning for bias mitigation in materials data.
      Python
      MIT License
      1000Updated Aug 29, 2023Aug 29, 2023
    • Data-driven Design Of Heterogeneous Metamaterial System (Poster for ICML 2022 Workshop on Machine Learning for Computational Design)
      0000Updated Jul 17, 2022Jul 17, 2022