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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 35 5

  2. cdvae-old cdvae-old Public

    Forked from txie-93/cdvae

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

    Python

  3. CrystalNets.jl CrystalNets.jl Public

    Forked from coudertlab/CrystalNets.jl

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

    Julia

  4. chemprop chemprop Public

    Forked from chemprop/chemprop

    Message Passing Neural Networks for Molecule Property Prediction

    Python

Repositories

Showing 4 of 4 repositories
  • Eunomia Public

    Chemist AI Agent for Developing Materials Datasets with Natural Language Prompts

    AI4ChemS/Eunomia’s past year of commit activity
    Python 35 MIT 5 2 1 Updated Sep 23, 2024
  • chemprop Public Forked from chemprop/chemprop

    Message Passing Neural Networks for Molecule Property Prediction

    AI4ChemS/chemprop’s past year of commit activity
    Python 0 584 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 93 0 0 Updated Mar 22, 2023

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