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The merged-geometry branch is a huge performance boost on larger molecules (ref). I ended up not implementing it because I wasn't concerned with performance at the time. Might be worth dusting off.
The text was updated successfully, but these errors were encountered:
The merged-geometry branch is a huge performance boost on larger molecules (ref). I ended up not implementing it because I wasn't concerned with performance at the time. Might be worth dusting off.
The text was updated successfully, but these errors were encountered: