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1 | < | /* |
1 | > | /* |
2 | * Copyright (c) 2005 The University of Notre Dame. All Rights Reserved. | |
3 | * | |
4 | * The University of Notre Dame grants you ("Licensee") a | |
# | Line 6 | Line 6 | |
6 | * redistribute this software in source and binary code form, provided | |
7 | * that the following conditions are met: | |
8 | * | |
9 | < | * 1. Acknowledgement of the program authors must be made in any |
10 | < | * publication of scientific results based in part on use of the |
11 | < | * program. An acceptable form of acknowledgement is citation of |
12 | < | * the article in which the program was described (Matthew |
13 | < | * A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher |
14 | < | * J. Fennell and J. Daniel Gezelter, "OOPSE: An Object-Oriented |
15 | < | * Parallel Simulation Engine for Molecular Dynamics," |
16 | < | * J. Comput. Chem. 26, pp. 252-271 (2005)) |
17 | < | * |
18 | < | * 2. Redistributions of source code must retain the above copyright |
9 | > | * 1. Redistributions of source code must retain the above copyright |
10 | * notice, this list of conditions and the following disclaimer. | |
11 | * | |
12 | < | * 3. Redistributions in binary form must reproduce the above copyright |
12 | > | * 2. Redistributions in binary form must reproduce the above copyright |
13 | * notice, this list of conditions and the following disclaimer in the | |
14 | * documentation and/or other materials provided with the | |
15 | * distribution. | |
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28 | * arising out of the use of or inability to use software, even if the | |
29 | * University of Notre Dame has been advised of the possibility of | |
30 | * such damages. | |
31 | + | * |
32 | + | * SUPPORT OPEN SCIENCE! If you use OpenMD or its source code in your |
33 | + | * research, please cite the appropriate papers when you publish your |
34 | + | * work. Good starting points are: |
35 | + | * |
36 | + | * [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). |
37 | + | * [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). |
38 | + | * [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). |
39 | + | * [4] Vardeman & Gezelter, in progress (2009). |
40 | */ | |
41 | ||
42 | #include "selection/TokenMap.hpp" | |
43 | ||
44 | < | namespace oopse { |
44 | > | namespace OpenMD { |
45 | ||
46 | < | TokenMap* TokenMap::instance_ = NULL; |
46 | > | TokenMap* TokenMap::instance_ = NULL; |
47 | ||
48 | < | TokenMap::TokenMap() { |
49 | < | tokenMap_.insert(std::make_pair("define", Token(Token::define, std::string("define")))); |
50 | < | tokenMap_.insert(std::make_pair("select", Token(Token::select, std::string("select")))); |
51 | < | //tokenMap_.insert(std::make_pair("selected", Token(Token::selected, std::string("selected")))); |
48 | > | TokenMap::TokenMap() { |
49 | > | tokenMap_.insert(TokenMapType::value_type("define", Token(Token::define, std::string("define")))); |
50 | > | tokenMap_.insert(TokenMapType::value_type("select", Token(Token::select, std::string("select")))); |
51 | > | //tokenMap_.insert(TokenMapType::value_type("selected", Token(Token::selected, std::string("selected")))); |
52 | ||
53 | //expressions | |
54 | < | tokenMap_.insert(std::make_pair("(", Token(Token::leftparen, std::string("(")))); |
55 | < | tokenMap_.insert(std::make_pair(")", Token(Token::rightparen, std::string(")")))); |
56 | < | tokenMap_.insert(std::make_pair("-", Token(Token::hyphen, std::string("-")))); |
54 | > | tokenMap_.insert(TokenMapType::value_type("(", Token(Token::leftparen, std::string("(")))); |
55 | > | tokenMap_.insert(TokenMapType::value_type(")", Token(Token::rightparen, std::string(")")))); |
56 | ||
57 | < | tokenMap_.insert(std::make_pair("and", Token(Token::opAnd, std::string("and")))); |
58 | < | tokenMap_.insert(std::make_pair("&", Token(Token::opAnd, std::string("and")))); |
59 | < | tokenMap_.insert(std::make_pair("&&", Token(Token::opAnd, std::string("and")))); |
57 | > | tokenMap_.insert(TokenMapType::value_type("and", Token(Token::opAnd, std::string("and")))); |
58 | > | tokenMap_.insert(TokenMapType::value_type("&", Token(Token::opAnd, std::string("and")))); |
59 | > | tokenMap_.insert(TokenMapType::value_type("&&", Token(Token::opAnd, std::string("and")))); |
60 | ||
61 | < | tokenMap_.insert(std::make_pair("or", Token(Token::opOr, std::string("or")))); |
62 | < | tokenMap_.insert(std::make_pair(",", Token(Token::opOr, std::string("or")))); |
63 | < | tokenMap_.insert(std::make_pair("|", Token(Token::opOr, std::string("or")))); |
64 | < | tokenMap_.insert(std::make_pair("||", Token(Token::opOr, std::string("or")))); |
61 | > | tokenMap_.insert(TokenMapType::value_type("or", Token(Token::opOr, std::string("or")))); |
62 | > | tokenMap_.insert(TokenMapType::value_type(",", Token(Token::opOr, std::string("or")))); |
63 | > | tokenMap_.insert(TokenMapType::value_type("|", Token(Token::opOr, std::string("or")))); |
64 | > | tokenMap_.insert(TokenMapType::value_type("||", Token(Token::opOr, std::string("or")))); |
65 | ||
66 | < | tokenMap_.insert(std::make_pair("not", Token(Token::opNot, std::string("not")))); |
67 | < | tokenMap_.insert(std::make_pair("!", Token(Token::opNot, std::string("not")))); |
66 | > | tokenMap_.insert(TokenMapType::value_type("not", Token(Token::opNot, std::string("not")))); |
67 | > | tokenMap_.insert(TokenMapType::value_type("!", Token(Token::opNot, std::string("not")))); |
68 | ||
69 | < | tokenMap_.insert(std::make_pair("<", Token(Token::opLT, std::string("<")))); |
70 | < | tokenMap_.insert(std::make_pair("<=", Token(Token::opLE, std::string("<=")))); |
71 | < | tokenMap_.insert(std::make_pair(">=", Token(Token::opGE, std::string(">=")))); |
72 | < | tokenMap_.insert(std::make_pair(">", Token(Token::opGT, std::string(">=")))); |
73 | < | tokenMap_.insert(std::make_pair("==", Token(Token::opEQ, std::string("==")))); |
74 | < | tokenMap_.insert(std::make_pair("!=", Token(Token::opNE, std::string("!=")))); |
75 | < | tokenMap_.insert(std::make_pair("within", Token(Token::within, std::string("within")))); |
76 | < | tokenMap_.insert(std::make_pair(".", Token(Token::dot, std::string(".")))); |
77 | < | tokenMap_.insert(std::make_pair("mass", Token(Token::mass, std::string("mass")))); |
78 | < | tokenMap_.insert(std::make_pair("dipole", Token(Token::dipole, std::string("dipole")))); |
79 | < | tokenMap_.insert(std::make_pair("charge", Token(Token::charge, std::string("charge")))); |
80 | < | //tokenMap_.insert(std::make_pair("name", Token(Token::name, std::string("name")))); |
81 | < | //tokenMap_.insert(std::make_pair("index", Token(Token::index, std::string("index")))); |
82 | < | //tokenMap_.insert(std::make_pair("molname", Token(Token::molname, std::string("molname")))); |
83 | < | //tokenMap_.insert(std::make_pair("molindex", Token(Token::molindex, std::string("molindex")))); |
69 | > | tokenMap_.insert(TokenMapType::value_type("<", Token(Token::opLT, std::string("<")))); |
70 | > | tokenMap_.insert(TokenMapType::value_type("<=", Token(Token::opLE, std::string("<=")))); |
71 | > | tokenMap_.insert(TokenMapType::value_type(">=", Token(Token::opGE, std::string(">=")))); |
72 | > | tokenMap_.insert(TokenMapType::value_type(">", Token(Token::opGT, std::string(">=")))); |
73 | > | tokenMap_.insert(TokenMapType::value_type("==", Token(Token::opEQ, std::string("==")))); |
74 | > | tokenMap_.insert(TokenMapType::value_type("!=", Token(Token::opNE, std::string("!=")))); |
75 | > | tokenMap_.insert(TokenMapType::value_type("within", Token(Token::within, std::string("within")))); |
76 | > | tokenMap_.insert(TokenMapType::value_type(".", Token(Token::dot, std::string(".")))); |
77 | > | tokenMap_.insert(TokenMapType::value_type("mass", Token(Token::mass, std::string("mass")))); |
78 | > | tokenMap_.insert(TokenMapType::value_type("charge", Token(Token::charge, std::string("charge")))); |
79 | > | tokenMap_.insert(TokenMapType::value_type("x", Token(Token::x, std::string("x")))); |
80 | > | tokenMap_.insert(TokenMapType::value_type("y", Token(Token::y, std::string("y")))); |
81 | > | tokenMap_.insert(TokenMapType::value_type("z", Token(Token::z, std::string("z")))); |
82 | > | tokenMap_.insert(TokenMapType::value_type("to", Token(Token::to, std::string("to")))); |
83 | > | |
84 | > | tokenMap_.insert(TokenMapType::value_type("all", Token(Token::all, std::string("all")))); |
85 | > | tokenMap_.insert(TokenMapType::value_type("none", Token(Token::none, std::string("none")))); |
86 | > | } |
87 | ||
88 | < | tokenMap_.insert(std::make_pair("*", Token(Token::asterisk, std::string("*")))); |
87 | < | tokenMap_.insert(std::make_pair("all", Token(Token::all, std::string("all")))); |
88 | < | tokenMap_.insert(std::make_pair("none", Token(Token::none, std::string("none")))); |
89 | < | } |
90 | < | |
91 | < | Token* TokenMap::getToken(const std::string& ident) { |
88 | > | Token* TokenMap::getToken(const std::string& ident) { |
89 | std::map<std::string, Token>::iterator i = tokenMap_.find(ident); | |
90 | ||
91 | return i != tokenMap_.end() ? &(i->second) : NULL; | |
92 | + | } |
93 | } | |
96 | – | } |
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