MTK++ Latest version: 0.2.0

superimpose.cpp File Reference

Superimposes molecules. More...

#include <sstream>
#include "superimpose.h"
#include "molecule.h"
#include "atom.h"
#include "Utils/vector3d.h"
#include "functionalize.h"
#include <Eigen/Dense>
#include <Eigen/Eigenvalues>
#include "Utils/diagonalize_eigen.h"
#include "Diagnostics/MTKException.h"
#include "Log/errorHandler.h"
Include dependency graph for superimpose.cpp:


namespace  MTKpp

MTK++ namespace.

Detailed Description

Superimposes molecules.

Martin Peters
2010/05/04 20:53:54


MTK++ - C++ package of modeling libraries.

Copyright (C) 2005-2006 (see AUTHORS file for a list of contributors)

This file is part of MTK++.

MTK++ is free software; you can redistribute it and/or modify it under the terms of the GNU Lesser General Public License as published by the Free Software Foundation; either version 3 of the License, or (at your option) any later version.

MTK++ is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU Lessser General Public License for more details.

You should have received a copy of the GNU Lesser General Public License along with this program. If not, see <>.


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