/*
* Project: MoleCuilder
* Description: creates and alters molecular systems
* Copyright (C) 2013 Frederik Heber. All rights reserved.
* Please see the COPYING file or "Copyright notice" in builder.cpp for details.
*
*
* 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 .
*/
/*
* PotentialDeserializer.cpp
*
* Created on: 09.05.2013
* Author: heber
*/
// include config.h
#ifdef HAVE_CONFIG_H
#include
#endif
#include "CodePatterns/MemDebug.hpp"
#include "PotentialDeserializer.hpp"
#include
#include
#include
#include "CodePatterns/Log.hpp"
#include "Potentials/PotentialFactory.hpp"
#include "Potentials/PotentialRegistry.hpp"
void PotentialDeserializer::operator()()
{
std::string linestring;
while (serialized.good()) {
getline(serialized, linestring);
const std::string whitespace(" \t");
const size_t strBegin = linestring.find_first_not_of(whitespace);
const size_t colonpos = linestring.find(":");
if ((strBegin != std::string::npos) && (colonpos != std::string::npos)) {
// get potential's token
const std::string token = linestring.substr(strBegin, colonpos);
std::stringstream potentialstream(linestring);
// instantiate type
EmpiricalPotential *potential =
PotentialFactory::getInstance().createInstance(
token, potentialstream);
// and register
PotentialRegistry::getInstance().registerInstance(potential);
} else {
ELOG(2, "Line '" << linestring << "' contains no potential.");
}
}
}