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) 2010-2012 University of Bonn. All rights reserved.
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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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21 | */
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22 |
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23 | /*
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24 | * AtomTypeDescriptor_impl.cpp
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25 | *
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26 | * Created on: Feb 25, 2010
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27 | * Author: crueger
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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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37 | #include "Descriptors/AtomTypeDescriptor.hpp"
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38 | #include "Descriptors/AtomTypeDescriptor_impl.hpp"
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39 |
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40 | #include "Atom/atom.hpp"
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41 | #include "World.hpp"
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42 | #include "Element/periodentafel.hpp"
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43 |
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44 | AtomTypeDescriptor_impl::AtomTypeDescriptor_impl(const element* _type) :
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45 | type(_type)
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46 | {}
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47 |
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48 | AtomTypeDescriptor_impl::~AtomTypeDescriptor_impl()
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49 | {}
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50 |
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51 | bool AtomTypeDescriptor_impl::predicate(std::pair<atomId_t,const atom*> atom) const {
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52 | return (atom.second->getType()==type);
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53 | }
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54 |
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55 | AtomDescriptor AtomByType(const element *elem){
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56 | return AtomDescriptor(AtomDescriptor::impl_ptr(new AtomTypeDescriptor_impl(elem)));
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57 | }
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58 |
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59 | AtomDescriptor AtomByType(int Z){
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60 | const element * elem = World::getInstance().getPeriode()->FindElement(Z);
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61 | return AtomByType(elem);
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62 | }
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