4 tagged dft, measured the same way as everything else here.
xjtulyc/awesome-rosetta-skills
Skill Claude CodeCodex
Atomic Simulation Environment (ASE) for atomistic simulations: structure building, geometry optimization, NEB, molecular dynamics, and trajectory analysis.
GEUConn/research-idea-workflow-skill
Skill Claude CodeCodex
This skill guides materials engineering researchers through four structured stages — from a raw idea to a fully planned experiment — with human-in-the-loop confirmation at each critical checkpoint.
At most 3 mods per repository are shown here, and a mod shipped inside a plugin is left to that plugin's page — the rest are on their repository pages: