/*
* Project: MoleCuilder
* Description: creates and alters molecular systems
* Copyright (C) 2013 Frederik Heber. All rights reserved.
*
*
* This file is part of MoleCuilder.
*
* MoleCuilder is free software: you can redistribute it and/or modify
* it under the terms of the GNU General Public License as published by
* the Free Software Foundation, either version 2 of the License, or
* (at your option) any later version.
*
* MoleCuilder 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 General Public License for more details.
*
* You should have received a copy of the GNU General Public License
* along with MoleCuilder. If not, see .
*/
/*
* getBoundingBox.cpp
*
* Created on: Sep 28, 2013
* Author: heber
*/
// include config.h
#ifdef HAVE_CONFIG_H
#include
#endif
#include "CodePatterns/MemDebug.hpp"
#include "modules.hpp"
#include "Box.hpp"
#include "CodePatterns/Assert.hpp"
#include "CodePatterns/Log.hpp"
#include "LinearAlgebra/Plane.hpp"
#include
#include
#include "World.hpp"
#include
/** =========== define the function ====================== */
MoleCuilder::detail::doubleVec MoleCuilder::detail::module_getBoundingBox()
{
typedef std::pair PairOfPlanes;
typedef std::vector PairOfPlanesVector;
const PairOfPlanesVector planes = World::getInstance().getDomain().getBoundingPlanes();
doubleVec returnvalues;
for (PairOfPlanesVector::const_iterator iter = planes.begin();
iter != planes.end(); ++iter) {
returnvalues.push_back(fabs(iter->first.getOffset()));
returnvalues.push_back(fabs(iter->second.getOffset()));
}
ASSERT( returnvalues.size() == (size_t)6,
"AnalysisCalculateBoundingBoxAction::doCalc() - returnvalues should be of length 6 but is "
+toString(returnvalues.size())+".");
LOG(0, "RESULT: The current bounding box is " << returnvalues << ".");
return returnvalues;
}