acellera-openff-nagl

A playground for applying graph convolutional networks to molecules.

Installation

In a virtualenv (see these instructions if you need to create one):

pip3 install acellera-openff-nagl

Dependencies

  • None

Releases

Version Released Bullseye
Python 3.9
Bookworm
Python 3.11
Trixie
Python 3.13
Files
0.5.4 2026-03-05      

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Page last updated 2026-05-12 18:56:43 UTC