Fix in structure::change_residue

b83ef112 · Maarten L. Hekkelman · dd9110a3 · b83ef112
Commit b83ef112 authored Nov 13, 2023 by Maarten L. Hekkelman
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src/model.cpp
+3 -0

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--- a/src/model.cpp
+++ b/src/model.cpp
@@ -2006,7 +2006,10 @@ void structure::change_residue(residue &res, const std::string &newCompound,
 			continue;

 		if (a2.empty() or a2 == ".")
+		{
+			i->set_property("label_comp_id", newCompound);
 			remove_atom(*i);
+		}
 		else if (a1 != a2)
 		{
 			auto ra = r.front();