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@AI4ChemS

AI4ChemS - Moosavi Group at the University of Toronto

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  1. Eunomia Eunomia Public

    Chemist AI Agent for Developing Materials Datasets with Natural Language Prompts

    Python 45 6

  2. FABO FABO Public

    Feature Adaptive Bayesian Optimization

    Jupyter Notebook 1

  3. XRayPro XRayPro Public

    A recommendation system for MOFs leveraging only PXRDs and precursors

    Python

  4. xraypro-web xraypro-web Public

    Python

Repositories

Showing 7 of 7 repositories
  • Eunomia Public

    Chemist AI Agent for Developing Materials Datasets with Natural Language Prompts

    AI4ChemS/Eunomia’s past year of commit activity
    Python 45 MIT 6 1 0 Updated Nov 13, 2024
  • xraypro-web Public
    AI4ChemS/xraypro-web’s past year of commit activity
    Python 0 MIT 0 0 0 Updated Oct 30, 2024
  • XRayPro Public

    A recommendation system for MOFs leveraging only PXRDs and precursors

    AI4ChemS/XRayPro’s past year of commit activity
    Python 0 MIT 0 0 0 Updated Oct 30, 2024
  • FABO Public

    Feature Adaptive Bayesian Optimization

    AI4ChemS/FABO’s past year of commit activity
    Jupyter Notebook 1 MIT 0 0 0 Updated Oct 25, 2024
  • chemprop Public Forked from chemprop/chemprop

    Message Passing Neural Networks for Molecule Property Prediction

    AI4ChemS/chemprop’s past year of commit activity
    Python 0 605 0 0 Updated Jul 30, 2024
  • CrystalNets.jl Public Forked from coudertlab/CrystalNets.jl

    A julia package for the manipulation of crystal net representations and topology

    AI4ChemS/CrystalNets.jl’s past year of commit activity
    Julia 0 MIT 3 0 0 Updated Jul 29, 2024
  • cdvae-old Public Forked from txie-93/cdvae

    An SE(3)-invariant autoencoder for generating the periodic structure of materials [ICLR 2022]

    AI4ChemS/cdvae-old’s past year of commit activity
    Python 0 MIT 99 0 0 Updated Mar 22, 2023

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