Accelerate molecular processing workflows
Datamol is an elegant, RDKit-powered Python library optimized for molecular machine-learning workflows.
An open-source hub of molecular featurizers
Molfeat makes it easy to evaluate and implement a wide range of featurizers directly into your workflow.
Scaling molecular GNNs to infinity.
A deep learning library focused on graph representation learning for real-world chemical task
datamol tutorials
These tutorials were last updated in August 2023. To see the updated tutorials, visit the documentation.
molfeat tutorials
These tutorials were lasted updated in August 2023. To see the updated tutorials, visit the documentation.
