ChemistryAtlas Code
a-r-j/graphein
Chemistry software and utilitiesGitHubsource codebioinformaticscomputational-biologydeep-learningdgldrug-discoverygene-regulatory-networksgeometric-deep-learninggraph-neural-networksinteractome
Protein Graph Library
Why it is useful: Chemistry software and utilities repository for chemistry, cheminformatics, molecular ML, simulation, synthesis, or drug discovery workflows.
GitHub signals: 1174 stars, 141 forks, primary language: Jupyter Notebook.
Homepage: https://graphein.ai/
Citation: GitHub repository: a-r-j/graphein