--- trunk/src/selection/TokenMap.cpp 2005/02/02 23:13:11 281 +++ trunk/src/selection/TokenMap.cpp 2009/11/25 20:02:06 1390 @@ -1,4 +1,4 @@ - /* +/* * Copyright (c) 2005 The University of Notre Dame. All Rights Reserved. * * The University of Notre Dame grants you ("Licensee") a @@ -6,19 +6,10 @@ * redistribute this software in source and binary code form, provided * that the following conditions are met: * - * 1. Acknowledgement of the program authors must be made in any - * publication of scientific results based in part on use of the - * program. An acceptable form of acknowledgement is citation of - * the article in which the program was described (Matthew - * A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher - * J. Fennell and J. Daniel Gezelter, "OOPSE: An Object-Oriented - * Parallel Simulation Engine for Molecular Dynamics," - * J. Comput. Chem. 26, pp. 252-271 (2005)) - * - * 2. Redistributions of source code must retain the above copyright + * 1. Redistributions of source code must retain the above copyright * notice, this list of conditions and the following disclaimer. * - * 3. Redistributions in binary form must reproduce the above copyright + * 2. Redistributions in binary form must reproduce the above copyright * notice, this list of conditions and the following disclaimer in the * documentation and/or other materials provided with the * distribution. @@ -37,48 +28,66 @@ * arising out of the use of or inability to use software, even if the * University of Notre Dame has been advised of the possibility of * such damages. + * + * SUPPORT OPEN SCIENCE! If you use OpenMD or its source code in your + * research, please cite the appropriate papers when you publish your + * work. Good starting points are: + * + * [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). + * [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). + * [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). + * [4] Vardeman & Gezelter, in progress (2009). */ #include "selection/TokenMap.hpp" -namespace oopse { +namespace OpenMD { -TokenMap* TokenMap::instance_ = NULL; + TokenMap* TokenMap::instance_ = NULL; -TokenMap::TokenMap() { - tokenMap_.insert(std::make_pair("define", Token(Token::define, std::string("define")))); - tokenMap_.insert(std::make_pair("select", Token(Token::select, std::string("select")))); + TokenMap::TokenMap() { + tokenMap_.insert(TokenMapType::value_type("define", Token(Token::define, std::string("define")))); + tokenMap_.insert(TokenMapType::value_type("select", Token(Token::select, std::string("select")))); + //tokenMap_.insert(TokenMapType::value_type("selected", Token(Token::selected, std::string("selected")))); + //expressions - tokenMap_.insert(std::make_pair("(", Token(Token::leftparen, std::string("(")))); - tokenMap_.insert(std::make_pair(")", Token(Token::rightparen, std::string(")")))); - tokenMap_.insert(std::make_pair("-", Token(Token::hyphen, std::string("-")))); - tokenMap_.insert(std::make_pair("and", Token(Token::opAnd, std::string("and")))); - tokenMap_.insert(std::make_pair("or", Token(Token::opOr, std::string("or")))); - tokenMap_.insert(std::make_pair("not", Token(Token::opNot, std::string("not")))); - tokenMap_.insert(std::make_pair("<", Token(Token::opLT, std::string("<")))); - tokenMap_.insert(std::make_pair("<=", Token(Token::opLE, std::string("<=")))); - tokenMap_.insert(std::make_pair(">=", Token(Token::opGE, std::string(">=")))); - tokenMap_.insert(std::make_pair(">", Token(Token::opGT, std::string(">=")))); - tokenMap_.insert(std::make_pair("==", Token(Token::opEQ, std::string("==")))); - tokenMap_.insert(std::make_pair("!=", Token(Token::opNE, std::string("!=")))); - tokenMap_.insert(std::make_pair("within", Token(Token::within, std::string("within")))); - tokenMap_.insert(std::make_pair(".", Token(Token::dot, std::string(".")))); - tokenMap_.insert(std::make_pair("mass", Token(Token::mass, std::string("mass")))); - tokenMap_.insert(std::make_pair("dipole", Token(Token::dipole, std::string("dipole")))); - tokenMap_.insert(std::make_pair("charge", Token(Token::charge, std::string("charge")))); - tokenMap_.insert(std::make_pair("name", Token(Token::name, std::string("name")))); - tokenMap_.insert(std::make_pair("index", Token(Token::index, std::string("index")))); - tokenMap_.insert(std::make_pair("molname", Token(Token::molname, std::string("molname")))); - tokenMap_.insert(std::make_pair("molindex", Token(Token::molindex, std::string("molindex")))); + tokenMap_.insert(TokenMapType::value_type("(", Token(Token::leftparen, std::string("(")))); + tokenMap_.insert(TokenMapType::value_type(")", Token(Token::rightparen, std::string(")")))); - tokenMap_.insert(std::make_pair("*", Token(Token::asterisk, std::string("*")))); - tokenMap_.insert(std::make_pair("all", Token(Token::all, std::string("all")))); - tokenMap_.insert(std::make_pair("none", Token(Token::none, std::string("none")))); -} + tokenMap_.insert(TokenMapType::value_type("and", Token(Token::opAnd, std::string("and")))); + tokenMap_.insert(TokenMapType::value_type("&", Token(Token::opAnd, std::string("and")))); + tokenMap_.insert(TokenMapType::value_type("&&", Token(Token::opAnd, std::string("and")))); -Token* TokenMap::getToken(const std::string& ident) { + tokenMap_.insert(TokenMapType::value_type("or", Token(Token::opOr, std::string("or")))); + tokenMap_.insert(TokenMapType::value_type(",", Token(Token::opOr, std::string("or")))); + tokenMap_.insert(TokenMapType::value_type("|", Token(Token::opOr, std::string("or")))); + tokenMap_.insert(TokenMapType::value_type("||", Token(Token::opOr, std::string("or")))); + + tokenMap_.insert(TokenMapType::value_type("not", Token(Token::opNot, std::string("not")))); + tokenMap_.insert(TokenMapType::value_type("!", Token(Token::opNot, std::string("not")))); + + tokenMap_.insert(TokenMapType::value_type("<", Token(Token::opLT, std::string("<")))); + tokenMap_.insert(TokenMapType::value_type("<=", Token(Token::opLE, std::string("<=")))); + tokenMap_.insert(TokenMapType::value_type(">=", Token(Token::opGE, std::string(">=")))); + tokenMap_.insert(TokenMapType::value_type(">", Token(Token::opGT, std::string(">=")))); + tokenMap_.insert(TokenMapType::value_type("==", Token(Token::opEQ, std::string("==")))); + tokenMap_.insert(TokenMapType::value_type("!=", Token(Token::opNE, std::string("!=")))); + tokenMap_.insert(TokenMapType::value_type("within", Token(Token::within, std::string("within")))); + tokenMap_.insert(TokenMapType::value_type(".", Token(Token::dot, std::string(".")))); + tokenMap_.insert(TokenMapType::value_type("mass", Token(Token::mass, std::string("mass")))); + tokenMap_.insert(TokenMapType::value_type("charge", Token(Token::charge, std::string("charge")))); + tokenMap_.insert(TokenMapType::value_type("x", Token(Token::x, std::string("x")))); + tokenMap_.insert(TokenMapType::value_type("y", Token(Token::y, std::string("y")))); + tokenMap_.insert(TokenMapType::value_type("z", Token(Token::z, std::string("z")))); + tokenMap_.insert(TokenMapType::value_type("to", Token(Token::to, std::string("to")))); + + tokenMap_.insert(TokenMapType::value_type("all", Token(Token::all, std::string("all")))); + tokenMap_.insert(TokenMapType::value_type("none", Token(Token::none, std::string("none")))); + } + + Token* TokenMap::getToken(const std::string& ident) { std::map::iterator i = tokenMap_.find(ident); return i != tokenMap_.end() ? &(i->second) : NULL; + } } -}