| 1 | /*
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| 2 |  * Project: MoleCuilder
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| 3 |  * Description: creates and alters molecular systems
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| 4 |  * Copyright (C)  2012 University of Bonn. All rights reserved.
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| 5 |  * Copyright (C)  2013 Frederik Heber. All rights reserved.
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| 6 |  * Please see the COPYING file or "Copyright notice" in builder.cpp for details.
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| 7 |  * 
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| 8 |  *
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| 9 |  *   This file is part of MoleCuilder.
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| 10 |  *
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| 11 |  *    MoleCuilder is free software: you can redistribute it and/or modify
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| 12 |  *    it under the terms of the GNU General Public License as published by
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| 13 |  *    the Free Software Foundation, either version 2 of the License, or
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| 14 |  *    (at your option) any later version.
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| 15 |  *
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| 16 |  *    MoleCuilder is distributed in the hope that it will be useful,
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| 17 |  *    but WITHOUT ANY WARRANTY; without even the implied warranty of
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| 18 |  *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
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| 19 |  *    GNU General Public License for more details.
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| 20 |  *
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| 21 |  *    You should have received a copy of the GNU General Public License
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| 22 |  *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>. 
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| 23 |  */
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| 24 | 
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| 25 | /*
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| 26 |  * FragmentMock.cpp
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| 27 |  *
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| 28 |  *  Created on: Dec 20, 2012
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| 29 |  *      Author: heber
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| 30 |  */
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| 31 | 
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| 32 | 
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| 33 | // include config.h
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| 34 | #ifdef HAVE_CONFIG_H
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| 35 | #include <config.h>
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| 36 | #endif
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| 37 | 
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| 38 | // include headers that implement a archive in simple text format
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| 39 | // otherwise BOOST_CLASS_EXPORT_IMPLEMENT has no effect
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| 40 | #include <boost/archive/text_oarchive.hpp>
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| 41 | #include <boost/archive/text_iarchive.hpp>
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| 42 | 
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| 43 | #include "CodePatterns/MemDebug.hpp"
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| 44 | 
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| 45 | #include "Fragmentation/Summation/SetValues/Fragment.hpp"
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| 46 | 
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| 47 | #include <iostream>
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| 48 | #include <vector>
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| 49 | 
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| 50 | /** Default constructor of class Fragment.
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| 51 |  *
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| 52 |  */
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| 53 | Fragment::Fragment() {}
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| 54 | 
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| 55 | /** Constructor of class Fragment.
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| 56 |  *
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| 57 |  * @param _positions given positions
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| 58 |  * @param _charges given charges
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| 59 |  */
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| 60 | Fragment::Fragment(const positions_t &_positions, const charges_t &_charges)
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| 61 | {}
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| 62 | 
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| 63 | /** Adding another fragment onto this one.
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| 64 |  *
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| 65 |  * \note The operation is area-conserving, i.e. the new area is the sum of
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| 66 |  * both areas.
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| 67 |  *
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| 68 |  * @param other other fragment
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| 69 |  * @return ref to this instance
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| 70 |  */
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| 71 | Fragment& Fragment::operator+=(const Fragment &other)
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| 72 |   { return *this; }
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| 73 | 
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| 74 | /** Assignment operator.
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| 75 |  *
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| 76 |  * @param other other fragment to make ourselves equal to
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| 77 |  * @return ref to this instance
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| 78 |  */
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| 79 | Fragment& Fragment::operator=(const Fragment &other)
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| 80 | { return *this; }
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| 81 | 
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| 82 | /** Subtracting another fragment from this one.
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| 83 |  *
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| 84 |  * @param other other fragment
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| 85 |  * @return ref to this instance
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| 86 |  */
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| 87 | Fragment& Fragment::operator-=(const Fragment &other)
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| 88 | { return *this; }
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| 89 | 
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| 90 | /** Getter for all stored positions.
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| 91 |  *
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| 92 |  * @return vector of positions
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| 93 |  */
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| 94 | Fragment::positions_t Fragment::getPositions() const
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| 95 | { return positions_t(); }
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| 96 | 
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| 97 | /** Getter for all stored charges.
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| 98 |  *
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| 99 |  * @return vector of charges
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| 100 |  */
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| 101 | Fragment::charges_t Fragment::getCharges() const
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| 102 | { return charges_t(); }
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| 103 | 
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| 104 | /** Equality operator.
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| 105 |  *
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| 106 |  * @param other other instance to check against
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| 107 |  * @return true - both are equal, false - some nucleus_t differ
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| 108 |  */
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| 109 | bool Fragment::operator==(const Fragment& other) const
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| 110 | { return true; }
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| 111 | 
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| 112 | /** Creates type nucleus_t from given \a position and \a charge.
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| 113 |  *
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| 114 |  * @param position position of nucleus to create
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| 115 |  * @param charge charge of nucleus to create
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| 116 |  * @return nucleus with given \a position and \a charge
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| 117 |  */
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| 118 | //  static nucleus_t Fragment::createNucleus(const position_t &position, const double charge);
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| 119 | 
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| 120 | /** Helper function to check whether two positions are equal.
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| 121 |  *
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| 122 |  * @param a first position
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| 123 |  * @param b second position
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| 124 |  * @return a equals b within numerical precision
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| 125 |  */
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| 126 | //  static bool Fragment::isPositionEqual(const position_t &a, const position_t &b);
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| 127 | 
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| 128 | //
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| 129 | //// we need to explicitly instantiate the serialization functions
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| 130 | //BOOST_CLASS_EXPORT_IMPLEMENT(Fragment)
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| 131 | 
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| 132 | /** Equality operator for two nuclei.
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| 133 |  *
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| 134 |  * @param a first nuclei
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| 135 |  * @param b second nuclei
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| 136 |  * @return true - both have same position and charge, false - either charge or position is different
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| 137 |  */
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| 138 | bool operator==(const Fragment::nucleus_t &a, const Fragment::nucleus_t &b)
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| 139 | { return true; }
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| 140 | 
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| 141 | std::ostream & operator<<(std::ostream &ost, const Fragment::nucleus_t &n)
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| 142 | { return ost; }
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| 143 | 
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| 144 | std::ostream & operator<<(std::ostream &ost, const Fragment &f)
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| 145 | { return ost; }
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