ChemistryAtlas Code
CDDLeiden/DrugEx
Generative molecular designGitHubsource codecheminformaticsde-novo-drug-designdeep-learningdrug-discoveryreinforcement-learning
De Novo Drug Design with RNNs and Transformers
Why it is useful: Generative molecular design repository for chemistry, cheminformatics, molecular ML, simulation, synthesis, or drug discovery workflows.
GitHub signals: 186 stars, 29 forks, primary language: Jupyter Notebook.
Homepage: https://cddleiden.github.io/DrugEx/docs/
Citation: GitHub repository: CDDLeiden/DrugEx