| 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, 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() { | 
| 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")))); | 
| 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("hull", Token(Token::hull, std::string("hull")))); | 
| 80 | + | tokenMap_.insert(TokenMapType::value_type("x", Token(Token::x, std::string("x")))); | 
| 81 | + | tokenMap_.insert(TokenMapType::value_type("y", Token(Token::y, std::string("y")))); | 
| 82 | + | tokenMap_.insert(TokenMapType::value_type("z", Token(Token::z, std::string("z")))); | 
| 83 | + | tokenMap_.insert(TokenMapType::value_type("r", Token(Token::z, std::string("r")))); | 
| 84 |  | tokenMap_.insert(TokenMapType::value_type("to", Token(Token::to, std::string("to")))); | 
| 85 |  |  | 
| 86 |  | tokenMap_.insert(TokenMapType::value_type("all", Token(Token::all, std::string("all")))); | 
| 87 |  | tokenMap_.insert(TokenMapType::value_type("none", Token(Token::none, std::string("none")))); | 
| 88 | < | } | 
| 88 | > | } | 
| 89 |  |  | 
| 90 | < | Token* TokenMap::getToken(const std::string& ident) { | 
| 90 | > | Token* TokenMap::getToken(const std::string& ident) { | 
| 91 |  | std::map<std::string, Token>::iterator i = tokenMap_.find(ident); | 
| 92 |  |  | 
| 93 |  | return i != tokenMap_.end() ? &(i->second) : NULL; | 
| 94 | + | } | 
| 95 |  | } | 
| 90 | – | } |