Find open-source science resources
A directory of tools, AI models, datasets, and research resources for biotech, bioinformatics, and other scientific fields. Aggregated from curated GitHub awesome-lists, HuggingFace, bio.tools, Bioconductor, and more.
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6 of 6,573 resources
Directed message passing neural networks for property prediction of molecules and reactions with uncertainty and interpretation.
A Python package for protein dynamics analysis
A swiss army knife for manipulating and editing PDB files.
Cheminformatic extension for the SQLAlchemy database.
Descriptor computation(chemistry) and (optional) storage for machine learning.
[RDKit](http://www.rdkit.org/) and [OSRA](https://cactus.nci.nih.gov/osra/) in the [Bottle](http://bottlepy.org/docs/dev/) on [Tornado](http://www.tornadoweb.org/en/stable/).