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1. coleygroup/rxn-ebm coleygroup/rxn-ebm Public

   Energy-based modeling of chemical reactions

   Python 29 7

2. neuralsym neuralsym Public

   Reimplementation of Segler et al's Template Relevance Network (NeuralSym) in their seminal Nature publication

   Python 31 7

3. tree_gen_net tree_gen_net Public

   re-implementation of Gao et al's paper on amortized molecular generation (2021)

   Python

4. neural-net-numpy neural-net-numpy Public

   a neural network from scratch in numpy

   Python

5. algorithms algorithms Public

   Python

6. energy_production_forecasting energy_production_forecasting Public

   Forked from kristoforusbryant/energy_production_forecasting

   Energy Demand Modelling for AI4Impact Datathon

   Jupyter Notebook 1