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            Last change
 on this file since 0ae114 was             cc6e5c, checked in by Frederik Heber <heber@…>, 11 years ago           | 
        
        
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Replaced Reactions by simple function exported to pyMoleCuilder. 
 
- Reactions are a bad idea from the start, calculations do not need to be
undone. Hence, why make them into an Action that is specifically undoable?
 - removed all Reaction..-related files.
 - removed ActinQueue::getLastAction().
 - removed CalculateBoundingBoxAction, CalculateCellVolumeAction, and
CalculateMolarMassAction, replaced by small function in Python folder.
 - TESTFIX: removed associated regression tests in Analysis.
 - modified boxmaker.py.in as names of functions changed.
 - removed Actions/pyMoleCuilder.cpp, is redunant with PythonScripting_impl.hpp.
  
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            File size:
            1.3 KB
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| [1540859] | 1 | /*
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 | 2 |  * Project: MoleCuilder
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 | 3 |  * Description: creates and alters molecular systems
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| [cc6e5c] | 4 |  * Copyright (C)  2013 Frederik Heber. All rights reserved.
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| [94d5ac6] | 5 |  * 
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 | 6 |  *
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 | 7 |  *   This file is part of MoleCuilder.
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 | 8 |  *
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 | 9 |  *    MoleCuilder is free software: you can redistribute it and/or modify
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 | 10 |  *    it under the terms of the GNU General Public License as published by
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 | 11 |  *    the Free Software Foundation, either version 2 of the License, or
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 | 12 |  *    (at your option) any later version.
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 | 13 |  *
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 | 14 |  *    MoleCuilder is distributed in the hope that it will be useful,
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 | 15 |  *    but WITHOUT ANY WARRANTY; without even the implied warranty of
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 | 16 |  *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
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 | 17 |  *    GNU General Public License for more details.
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 | 18 |  *
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 | 19 |  *    You should have received a copy of the GNU General Public License
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 | 20 |  *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>.
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| [1540859] | 21 |  */
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 | 22 | 
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 | 23 | /*
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| [cc6e5c] | 24 |  * exit.cpp
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| [1540859] | 25 |  *
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| [cc6e5c] | 26 |  *  Created on: Sep 28, 2013
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| [1540859] | 27 |  *      Author: heber
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 | 28 |  */
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 | 29 | 
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 | 30 | // include config.h
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 | 31 | #ifdef HAVE_CONFIG_H
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 | 32 | #include <config.h>
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 | 33 | #endif
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 | 34 | 
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 | 35 | #include "CodePatterns/MemDebug.hpp"
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 | 36 | 
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| [cc6e5c] | 37 | #include "modules.hpp"
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| [54088a] | 38 | 
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 | 39 | #include <iostream>
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 | 40 | 
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| [cc6e5c] | 41 | #include "cleanUp.hpp"
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| [1540859] | 42 | 
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| [cc6e5c] | 43 | void MoleCuilder::detail::module_exit()
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 | 44 | {
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 | 45 |   // save everything
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 | 46 |   std::cout << "Saving." << std::endl;
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 | 47 |   saveAll();
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 | 48 |   // purge everything
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 | 49 |   std::cout << "Cleaning memory." << std::endl;
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 | 50 |   cleanUp();
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| [54088a] | 51 | }
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