gasteigerjo / dimenet

DimeNet and DimeNet++ models, as proposed in "Directional Message Passing for Molecular Graphs" (ICLR 2020) and "Fast and Uncertainty-Aware Directional Message Passing for Non-Equilibrium Molecules" (NeurIPS-W 2020)
https://www.daml.in.tum.de/dimenet
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How did you make the diagrams? #14

Closed sgbaird closed 3 years ago

sgbaird commented 3 years ago

Looks really nice, just curious what was used for it. https://github.com/klicperajo/dimenet/raw/master/architecture.svg?raw=true&sanitize=true

gasteigerjo commented 3 years ago

Thank you! I used TikZ for this. It's a lot of work, but the results are quite nice. Not sure if I would do it again that way, though. Inkscape might have been easier.