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root/OpenMD/branches/development/src/selection/TokenMap.cpp
Revision: 1854
Committed: Thu Mar 28 20:54:06 2013 UTC (12 years, 1 month ago) by gezelter
File size: 5895 byte(s)
Log Message:
First pass at angular momentum aware version of VSS-RNEMD.

File Contents

# Content
1 /*
2 * Copyright (c) 2005 The University of Notre Dame. All Rights Reserved.
3 *
4 * The University of Notre Dame grants you ("Licensee") a
5 * non-exclusive, royalty free, license to use, modify and
6 * redistribute this software in source and binary code form, provided
7 * that the following conditions are met:
8 *
9 * 1. Redistributions of source code must retain the above copyright
10 * notice, this list of conditions and the following disclaimer.
11 *
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.
16 *
17 * This software is provided "AS IS," without a warranty of any
18 * kind. All express or implied conditions, representations and
19 * warranties, including any implied warranty of merchantability,
20 * fitness for a particular purpose or non-infringement, are hereby
21 * excluded. The University of Notre Dame and its licensors shall not
22 * be liable for any damages suffered by licensee as a result of
23 * using, modifying or distributing the software or its
24 * derivatives. In no event will the University of Notre Dame or its
25 * licensors be liable for any lost revenue, profit or data, or for
26 * direct, indirect, special, consequential, incidental or punitive
27 * damages, however caused and regardless of the theory of liability,
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, 234107 (2008).
39 * [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010).
40 * [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011).
41 */
42
43 #include "selection/TokenMap.hpp"
44
45 namespace OpenMD {
46
47 TokenMap* TokenMap::instance_ = NULL;
48
49 TokenMap::TokenMap() {
50 tokenMap_.insert(TokenMapType::value_type("define", Token(Token::define, std::string("define"))));
51 tokenMap_.insert(TokenMapType::value_type("select", Token(Token::select, std::string("select"))));
52 //tokenMap_.insert(TokenMapType::value_type("selected", Token(Token::selected, std::string("selected"))));
53
54 //expressions
55 tokenMap_.insert(TokenMapType::value_type("(", Token(Token::leftparen, std::string("("))));
56 tokenMap_.insert(TokenMapType::value_type(")", Token(Token::rightparen, std::string(")"))));
57
58 tokenMap_.insert(TokenMapType::value_type("and", Token(Token::opAnd, std::string("and"))));
59 tokenMap_.insert(TokenMapType::value_type("&", Token(Token::opAnd, std::string("and"))));
60 tokenMap_.insert(TokenMapType::value_type("&&", Token(Token::opAnd, std::string("and"))));
61
62 tokenMap_.insert(TokenMapType::value_type("or", 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 tokenMap_.insert(TokenMapType::value_type("||", Token(Token::opOr, std::string("or"))));
66
67 tokenMap_.insert(TokenMapType::value_type("not", Token(Token::opNot, std::string("not"))));
68 tokenMap_.insert(TokenMapType::value_type("!", Token(Token::opNot, std::string("not"))));
69
70 tokenMap_.insert(TokenMapType::value_type("<", Token(Token::opLT, std::string("<"))));
71 tokenMap_.insert(TokenMapType::value_type("<=", Token(Token::opLE, std::string("<="))));
72 tokenMap_.insert(TokenMapType::value_type(">=", Token(Token::opGE, std::string(">="))));
73 tokenMap_.insert(TokenMapType::value_type(">", Token(Token::opGT, std::string(">"))));
74 tokenMap_.insert(TokenMapType::value_type("==", Token(Token::opEQ, std::string("=="))));
75 tokenMap_.insert(TokenMapType::value_type("!=", Token(Token::opNE, std::string("!="))));
76 tokenMap_.insert(TokenMapType::value_type("within", Token(Token::within, std::string("within"))));
77 tokenMap_.insert(TokenMapType::value_type(".", Token(Token::dot, std::string("."))));
78 tokenMap_.insert(TokenMapType::value_type("mass", Token(Token::mass, std::string("mass"))));
79 tokenMap_.insert(TokenMapType::value_type("charge", Token(Token::charge, std::string("charge"))));
80 tokenMap_.insert(TokenMapType::value_type("hull", Token(Token::hull, std::string("hull"))));
81 tokenMap_.insert(TokenMapType::value_type("x", Token(Token::x, std::string("x"))));
82 tokenMap_.insert(TokenMapType::value_type("y", Token(Token::y, std::string("y"))));
83 tokenMap_.insert(TokenMapType::value_type("z", Token(Token::z, std::string("z"))));
84 tokenMap_.insert(TokenMapType::value_type("wrappedx", Token(Token::wrappedX, std::string("wrappedx"))));
85 tokenMap_.insert(TokenMapType::value_type("wrappedy", Token(Token::wrappedY, std::string("wrappedy"))));
86 tokenMap_.insert(TokenMapType::value_type("wrappedz", Token(Token::wrappedZ, std::string("wrappedz"))));
87 tokenMap_.insert(TokenMapType::value_type("r", Token(Token::r, std::string("r"))));
88 tokenMap_.insert(TokenMapType::value_type("to", Token(Token::to, std::string("to"))));
89
90 tokenMap_.insert(TokenMapType::value_type("all", Token(Token::all, std::string("all"))));
91 tokenMap_.insert(TokenMapType::value_type("none", Token(Token::none, std::string("none"))));
92 }
93
94 Token* TokenMap::getToken(const std::string& ident) {
95 std::map<std::string, Token>::iterator i = tokenMap_.find(ident);
96
97 return i != tokenMap_.end() ? &(i->second) : NULL;
98 }
99 }

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