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.

5 of 5,923 resources

The Open Forcefield Toolkit provides implementations of the SMIRNOFF format, parameterization engine, and other tools.

Active39415 hours ago
Python
MIT

Tool to build force field input files for molecular simulation.

Active2012 months ago
Python
MIT

Neural Network Force Field based on PyTorch.

Active2904 months ago
Jupyter Notebook
MIT

A package for creating fast and accurate interatomic potentials.

Active3584 months ago
Python
MIT

A Package For Training SNAP Interatomic Potentials for use in the LAMMPS molecular dynamics package.

Idle1867 months ago
Python
GPL-2.0