From e5a17cd601bfad8bb58502cbdddcfdcf47f4936d Mon Sep 17 00:00:00 2001
From: Gerardo Tauriello <gerardo.tauriello@unibas.ch>
Date: Fri, 27 Apr 2018 21:53:40 +0200
Subject: [PATCH] Fix: keep entity name when molcking.
---
modules/mol/alg/src/molck.cc | 3 ++-
1 file changed, 2 insertions(+), 1 deletion(-)
diff --git a/modules/mol/alg/src/molck.cc b/modules/mol/alg/src/molck.cc
index e1c35083f..294e996b9 100644
--- a/modules/mol/alg/src/molck.cc
+++ b/modules/mol/alg/src/molck.cc
@@ -10,7 +10,8 @@ using namespace ost::mol;
void ost::mol::alg::MapNonStandardResidues(EntityHandle& ent, CompoundLibPtr lib) {
// TODO: Maybe it is possible to make it in-place operation
- EntityHandle new_ent=CreateEntity();
+ EntityHandle new_ent=CreateEntity();
+ new_ent.SetName(ent.GetName());
ChainHandleList chains=ent.GetChainList();
XCSEditor new_edi=new_ent.EditXCS();
for (ChainHandleList::const_iterator c=chains.begin();c!=chains.end();++c) {
--
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