ChemistryAtlas Code
Mariewelt/OpenChem
Drug discovery and ADMET MLGitHubsource codecomputational-biologycomputational-chemistrydeep-learningdeep-neural-networksdrug-designdrug-discoverygraph-convolutional-networksmachine-learningpredictive-modeling
OpenChem: Deep Learning toolkit for Computational Chemistry and Drug Design Research
Why it is useful: Drug discovery and ADMET ML repository for chemistry, cheminformatics, molecular ML, simulation, synthesis, or drug discovery workflows.
GitHub signals: 746 stars, 120 forks, primary language: Python.
Homepage: https://mariewelt.github.io/OpenChem/
Citation: GitHub repository: Mariewelt/OpenChem