What is PhysicsML?

PhysicsML is a package for all physics based/related models. It provides a standardised interface for handling, building, and training 3d models!

Installation

With pip

pip install physicsml

Optional Dependencies

Some functionalities in physicsml require additional dependencies, which you can install as needed. For example

pip install physicsml[rdkit]

Documentation

To learn more about how to use physicsml, see the documentation.

Contribution guidelines

Anyone is welcome to submit PRs for new functionality or fixes! Just create a pull request and we will review and get back to you.

License

MIT License

Acknowledgements

The physicsml package has been developed by researchers at Exscientia

• Adam Baskerville
• Aayush Gupta
• Ward Haddadin
• Kavindri Ranasinghe
• Ben Suutari