From 0997bfe67a8800a07570c349bffb38afeb4afffa Mon Sep 17 00:00:00 2001
From: Tobias Schmidt <tobias.schmidt@unibas.ch>
Date: Fri, 1 Jul 2011 15:02:27 +0200
Subject: [PATCH] fixed CHARMM dialect PDBWriter (BZDNG-275)
---
modules/io/src/mol/pdb_writer.cc | 2 +-
1 file changed, 1 insertion(+), 1 deletion(-)
diff --git a/modules/io/src/mol/pdb_writer.cc b/modules/io/src/mol/pdb_writer.cc
index 98022a0a5..ffbd145fa 100644
--- a/modules/io/src/mol/pdb_writer.cc
+++ b/modules/io/src/mol/pdb_writer.cc
@@ -92,7 +92,7 @@ void write_atom(std::ostream& ostr, FormattedLine& line,
"' is too long for CHARMM-PDB output. At most 4 "
"characters are allowed");
}
- line(17, 4)=fmt::LPadded(res.GetKey());
+ line(17, 4)=fmt::RPadded(res.GetKey());
} else {
if (res.GetKey().size()>3) {
throw IOException("Residue name '"+res.GetName()+
--
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