Molecule
Showing 7 of 7 projects
A comprehensive collection of Ansible examples and playbooks for learning infrastructure automation and DevOps practices.
A Python package for applying graph neural networks to molecular graphs and biological networks in life science research.
A Python library for molecular processing built on RDKit with a simple API and good defaults.
A Python library for molecular processing built on RDKit with a simple API and good defaults.
A Julia toolkit for graph-based molecule modeling, cheminformatics analysis, and chemical structure manipulation.
A conversational AI framework for editing small molecules, peptides, and proteins using retrieval-augmented generation and domain feedback.
A GitHub Action to test Ansible roles using Molecule with Docker containers.
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