| 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 |
| 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. |
| 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 oopse { |
| 45 |
> |
namespace OpenMD { |
| 46 |
|
|
| 47 |
< |
TokenMap* TokenMap::instance_ = NULL; |
| 47 |
> |
TokenMap* TokenMap::instance_ = NULL; |
| 48 |
|
|
| 49 |
< |
TokenMap::TokenMap() { |
| 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")))); |
| 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(">=")))); |
| 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 |
< |
} |
| 92 |
> |
} |
| 93 |
|
|
| 94 |
< |
Token* TokenMap::getToken(const std::string& ident) { |
| 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 |
+ |
|
| 100 |
+ |
TokenMap::~TokenMap() { |
| 101 |
+ |
tokenMap_.clear(); |
| 102 |
+ |
} |
| 103 |
|
} |
| 90 |
– |
} |
