source: src/Jobs/MPQCJob.cpp@ 28e894

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Last change on this file since 28e894 was 28e894, checked in by Frederik Heber <heber@…>, 12 years ago

FragmentationAutomationAction now creates MPQCJobs.

  • MPQCJobs are simply MPQCCommandJobs without the command, i.e. they do not inherit SystemCommandJob but derived directly from mpqc and receive the inputfile via JobMarket's FragmentJob and also transmit the results directly encapsulated in MPQCData in a FragmentResult.
  • Property mode set to 100644
File size: 1.8 KB
Line 
1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2012 University of Bonn. All rights reserved.
5 *
6 *
7 * This file is part of MoleCuilder.
8 *
9 * MoleCuilder is free software: you can redistribute it and/or modify
10 * it under the terms of the GNU General Public License as published by
11 * the Free Software Foundation, either version 2 of the License, or
12 * (at your option) any later version.
13 *
14 * MoleCuilder is distributed in the hope that it will be useful,
15 * but WITHOUT ANY WARRANTY; without even the implied warranty of
16 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
17 * GNU General Public License for more details.
18 *
19 * You should have received a copy of the GNU General Public License
20 * along with MoleCuilder. If not, see <http://www.gnu.org/licenses/>.
21 */
22
23/*
24 * MPQCJob.cpp
25 *
26 * Created on: Jul 10, 2012
27 * Author: heber
28 */
29
30
31// include config.h
32#ifdef HAVE_CONFIG_H
33#include <config.h>
34#endif
35
36// include headers that implement a archive in simple text format
37// otherwise BOOST_CLASS_EXPORT_IMPLEMENT has no effect
38#include <boost/archive/text_oarchive.hpp>
39#include <boost/archive/text_iarchive.hpp>
40
41#include "CodePatterns/MemDebug.hpp"
42
43#include "Jobs/MPQCJob.hpp"
44#include "Jobs/MPQCCommandJob_MPQCData.hpp"
45
46#include <sstream>
47
48FragmentResult::ptr MPQCJob::Work()
49{
50 std::stringstream returnstream;
51 MPQCData data;
52 // place into returnstream
53 boost::archive::text_oarchive oa(returnstream);
54 oa << data;
55
56 FragmentResult::ptr ptr( new FragmentResult(getId(), returnstream.str()) );
57 return ptr;
58}
59
60// we need to explicitly instantiate the serialization functions as
61// its is only serialized through its base class FragmentJob
62BOOST_CLASS_EXPORT_IMPLEMENT(MPQCJob)
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