Proline termini mappings

marrink-lab / vermouth-martinize

Describe and apply transformation on molecular structures and topologies

Apache License 2.0

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Proline termini mappings #476

Closed pckroon closed 1 year ago

pckroon commented 1 year ago

This PR fixes part of #472, namely the proline termini mappings

fgrunewald commented 1 year ago

@pckroon I think this one is fine as well. Even if the names are not 100% aligned I think it should still work. We can worry about Amber implementation later.