marrink-lab / vermouth-martinize

Describe and apply transformation on molecular structures and topologies
Apache License 2.0
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Documentation #545

Closed pckroon closed 10 months ago

pckroon commented 1 year ago

This is my start for updating the documentation. I still want to have a go at the tutorials folder, which is currently pretty much empty. I think I'll add one on how to add a residue

The built docs for this PR can be found here: https://vermouth-martinize.readthedocs.io/en/documentation/

fgrunewald commented 1 year ago

@pckroon just FYI for more simulation heavy tutorial files we also have the martinze2 example repro

pckroon commented 1 year ago

Oh excellent! I'll refer to that

pckroon commented 1 year ago

The built docs for this PR can be found here: https://vermouth-martinize.readthedocs.io/en/documentation/