Foyer: A package for atom-typing as well as applying and disseminating forcefields
Contained in this repository are a series of tutorials to introduce new users to the Foyer package for constructing molecular systems. The user is referred to Foyer's documentation for installation instructions.
How do I run these tutorials?
The Foyer tutorials can be completed in two ways:
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Creating the proper Python environment (the user is again referred to Foyer's installation instructions), cloning this repository, and launcing a local Jupyter notebook server with
jupyter notebook -
Using our Binder link, where a Jupyter notebook server will be launched in the cloud with the proper Python environment pre-configured.