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Fix 2051 #2052

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Fix 2051 #2052

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@j-wags j-wags commented Apr 30, 2025

Status: I need to think about this more, since it may have introduced a bug elsewhere (I don't totally understand the code path that was changed). I'll open this for review later but will provide @barmoral with instructions on how to install from this branch for now.

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codecov bot commented Apr 30, 2025

Codecov Report

All modified and coverable lines are covered by tests ✅

Project coverage is 82.60%. Comparing base (fc6402f) to head (b9993c3).

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Topology.from_pdb can't handle NH4+
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