Add UPU46 benchmark#238

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kuryla wants to merge 5 commits intoddmms:mainfrom

Commits on Jan 12, 2026

Add UPU46 calculation files

Domantas Kuryla
authored and
ElliottKasoar
committed
Add UPU46 analysis files

Domantas Kuryla
authored and
ElliottKasoar
committed
upu46 app

joehart2001
authored and
ElliottKasoar
committed
Tidy upu46 and use kcal/mol
ElliottKasoar
committed
Rename UPU46
ElliottKasoar
committed