Open Babel
3.0
include
openbabel
kekulize.h
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/**********************************************************************
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Copyright (C) 2017 Noel M. O'Boyle
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This file is part of the Open Babel project.
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For more information, see <http://openbabel.org/>
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This program is free software; you can redistribute it and/or modify
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it under the terms of the GNU General Public License as published by
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the Free Software Foundation version 2 of the License.
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This program is distributed in the hope that it will be useful,
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but WITHOUT ANY WARRANTY; without even the implied warranty of
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MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
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GNU General Public License for more details.
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***********************************************************************/
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#ifndef OB_KEKULIZE_H
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#define OB_KEKULIZE_H
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namespace
OpenBabel
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{
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OBAPI
bool
OBKekulize
(OBMol *mol);
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}
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#endif //OB_KEKULIZE_H
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OpenBabel::OBKekulize
bool OBKekulize(OBMol *mol)
Kekulize a molecule by assigning bond orders of 1 or 2 to aromatic bonds.
Definition:
kekulize.cpp:411
OpenBabel
Global namespace for all Open Babel code.
Definition:
alias.h:22
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