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Modifications for "custom" forcefields #31

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ctk3b opened this issue Sep 30, 2016 · 0 comments
Closed

Modifications for "custom" forcefields #31

ctk3b opened this issue Sep 30, 2016 · 0 comments
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@ctk3b
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ctk3b commented Sep 30, 2016

Modify Foyer to accept a specific .itp file and specific rules.py file (also make it so you can easily define rules in a notebook and pass them to foyer).

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