| 1 | tim | 1961 | /* | 
| 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. 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 | 
| 19 |  |  | *    notice, this list of conditions and the following disclaimer. | 
| 20 |  |  | * | 
| 21 |  |  | * 3. Redistributions in binary form must reproduce the above copyright | 
| 22 |  |  | *    notice, this list of conditions and the following disclaimer in the | 
| 23 |  |  | *    documentation and/or other materials provided with the | 
| 24 |  |  | *    distribution. | 
| 25 |  |  | * | 
| 26 |  |  | * This software is provided "AS IS," without a warranty of any | 
| 27 |  |  | * kind. All express or implied conditions, representations and | 
| 28 |  |  | * warranties, including any implied warranty of merchantability, | 
| 29 |  |  | * fitness for a particular purpose or non-infringement, are hereby | 
| 30 |  |  | * excluded.  The University of Notre Dame and its licensors shall not | 
| 31 |  |  | * be liable for any damages suffered by licensee as a result of | 
| 32 |  |  | * using, modifying or distributing the software or its | 
| 33 |  |  | * derivatives. In no event will the University of Notre Dame or its | 
| 34 |  |  | * licensors be liable for any lost revenue, profit or data, or for | 
| 35 |  |  | * direct, indirect, special, consequential, incidental or punitive | 
| 36 |  |  | * damages, however caused and regardless of the theory of liability, | 
| 37 |  |  | * arising out of the use of or inability to use software, even if the | 
| 38 |  |  | * University of Notre Dame has been advised of the possibility of | 
| 39 |  |  | * such damages. | 
| 40 |  |  | */ | 
| 41 |  |  |  | 
| 42 |  |  | #ifndef SELECTION_TOKEN_HPP | 
| 43 |  |  | #define SELECTION_TOKEN_HPP | 
| 44 |  |  |  | 
| 45 |  |  |  | 
| 46 |  |  | namespace oopse { | 
| 47 |  |  |  | 
| 48 |  |  |  | 
| 49 |  |  | /** | 
| 50 |  |  | * @class Token | 
| 51 |  |  | * @todo document | 
| 52 |  |  | */ | 
| 53 |  |  | class Token { | 
| 54 |  |  |  | 
| 55 |  |  | public: | 
| 56 |  |  |  | 
| 57 |  |  | int tok; | 
| 58 |  |  | int intValue; | 
| 59 |  |  |  | 
| 60 |  |  | const static int nada              =  0; | 
| 61 |  |  | const static int identifier        =  1; | 
| 62 |  |  | const static int integer           =  2; | 
| 63 |  |  | const static int decimal           =  3; | 
| 64 |  |  | const static int string            =  4; | 
| 65 |  |  | const static int seqcode           =  5; | 
| 66 |  |  | const static int unknown           =  6; | 
| 67 |  |  | const static int keyword           =  7; | 
| 68 |  |  | const static int whitespace        =  8; | 
| 69 |  |  | const static int comment           =  9; | 
| 70 |  |  | const static int endofline         = 10; | 
| 71 |  |  | const static int endofstatement    = 11; | 
| 72 |  |  |  | 
| 73 |  |  | const static int command           = (1 <<  8); | 
| 74 |  |  | const static int expressionCommand = (1 <<  9); // expression command | 
| 75 |  |  | const static int expression        = (1 << 15); /// expression term | 
| 76 |  |  |  | 
| 77 |  |  | // every property is also valid in an expression context | 
| 78 |  |  | const static int atomproperty      = (1 << 16) | expression; | 
| 79 |  |  | // every predefined is also valid in an expression context | 
| 80 |  |  | const static int comparator        = (1 << 17) | expression; | 
| 81 |  |  | const static int predefinedset     = (1 << 18) | expression; | 
| 82 |  |  | // generally, the minus sign is used to denote atom ranges | 
| 83 |  |  | // this property is used for the few commands which allow negative integers | 
| 84 |  |  | const static int negnums      = (1 << 21); | 
| 85 |  |  | // for some commands the 'set' is optional | 
| 86 |  |  |  | 
| 87 |  |  | // These are unrelated | 
| 88 |  |  | const static int varArgCount       = (1 << 4); | 
| 89 |  |  | const static int onDefault1        = (1 << 5) | 1; | 
| 90 |  |  |  | 
| 91 |  |  | // rasmol commands | 
| 92 |  |  | const static int define       = command | expressionCommand |1; | 
| 93 |  |  | const static int select       = command |expressionCommand |2 ; | 
| 94 |  |  | const static int all          = expression | 11 ; | 
| 95 |  |  |  | 
| 96 |  |  | // atom expression operators | 
| 97 |  |  | const static int leftparen    = expression |  0; | 
| 98 |  |  | const static int rightparen   = expression |  1; | 
| 99 |  |  | const static int hyphen       = expression |  2; | 
| 100 |  |  | const static int opAnd        = expression |  3; | 
| 101 |  |  | const static int opOr         = expression |  4; | 
| 102 |  |  | const static int opNot        = expression |  5; | 
| 103 |  |  | const static int within       = expression |  6; | 
| 104 |  |  | const static int plus         = expression |  7; | 
| 105 |  |  | const static int pick         = expression |  8; | 
| 106 |  |  | const static int asterisk     = expression |  9; | 
| 107 |  |  | const static int dot          = expression | 11; | 
| 108 |  |  | const static int leftsquare   = expression | 12; | 
| 109 |  |  | const static int rightsquare  = expression | 13; | 
| 110 |  |  | const static int colon        = expression | 14; | 
| 111 |  |  | const static int slash        = expression | 15; | 
| 112 |  |  |  | 
| 113 |  |  | // miguel 2005 01 01 | 
| 114 |  |  | // these are used to demark the beginning and end of expressions | 
| 115 |  |  | // they do not exist in the source code, but are emitted by the | 
| 116 |  |  | // expression compiler | 
| 117 |  |  | const static int expressionBegin = expression | 100; | 
| 118 |  |  | const static int expressionEnd   = expression | 101; | 
| 119 |  |  |  | 
| 120 |  |  | const static int atomno       = atomproperty | 0; | 
| 121 |  |  | const static int elemno       = atomproperty | 1; | 
| 122 |  |  | const static int resno        = atomproperty | 2; | 
| 123 |  |  | const static int radius       = atomproperty | 3 ; | 
| 124 |  |  | const static int _bondedcount = atomproperty | 6; | 
| 125 |  |  | const static int _groupID     = atomproperty | 7; | 
| 126 |  |  | const static int _atomID      = atomproperty | 8; | 
| 127 |  |  | const static int _structure   = atomproperty | 9; | 
| 128 |  |  | const static int occupancy    = atomproperty | 10; | 
| 129 |  |  | const static int polymerLength= atomproperty | 11; | 
| 130 |  |  |  | 
| 131 |  |  | const static int opGT         = comparator |  0; | 
| 132 |  |  | const static int opGE         = comparator |  1; | 
| 133 |  |  | const static int opLE         = comparator |  2; | 
| 134 |  |  | const static int opLT         = comparator |  3; | 
| 135 |  |  | const static int opEQ         = comparator |  4; | 
| 136 |  |  | const static int opNE         = comparator |  5; | 
| 137 |  |  |  | 
| 138 |  |  | const static int x            =  expression |2; | 
| 139 |  |  | const static int y            =  expression | 3; | 
| 140 |  |  | const static int z            =  expression | 4; | 
| 141 |  |  | const static int none      =  expression | 5; | 
| 142 |  |  |  | 
| 143 |  |  |  | 
| 144 |  |  | const static Token tokenAll(all, "all"); | 
| 145 |  |  | const static Token tokenAnd(opAnd, "and"); | 
| 146 |  |  | const static Token tokenElemno(elemno, "elemno"); | 
| 147 |  |  | const static Token tokenExpressionBegin(expressionBegin, "expressionBegin"); | 
| 148 |  |  | const static Token tokenExpressionEnd(expressionEnd, "expressionEnd"); | 
| 149 |  |  |  | 
| 150 |  |  |  | 
| 151 |  |  | const static String[] comparatorNames = {">", ">=", "<=", "<", "=", "!="}; | 
| 152 |  |  | const static String[] atomPropertyNames = { | 
| 153 |  |  | "atomno", "elemno", "resno", "radius", "temperature", "model", | 
| 154 |  |  | "_bondedcount", "_groupID", "_atomID", "_structure"}; | 
| 155 |  |  |  | 
| 156 |  |  | /* | 
| 157 |  |  | Note that the RasMol scripting language is case-insensitive. | 
| 158 |  |  | So, the compiler turns all identifiers to lower-case before | 
| 159 |  |  | looking up in the hash table. | 
| 160 |  |  | Therefore, the left column of this array *must* be lower-case | 
| 161 |  |  | */ | 
| 162 |  |  |  | 
| 163 |  |  | const static Object[] arrayPairs  = { | 
| 164 |  |  | // commands | 
| 165 |  |  | "define",            new Token(define,   varArgCount, "define"), | 
| 166 |  |  | "select",            new Token(select,   varArgCount, "select"), | 
| 167 |  |  | // atom expressions | 
| 168 |  |  | "(",            new Token(leftparen, "("), | 
| 169 |  |  | ")",            new Token(rightparen, ")"), | 
| 170 |  |  | "-",            new Token(hyphen, "-"), | 
| 171 |  |  | "and",          tokenAnd, | 
| 172 |  |  | "&",            null, | 
| 173 |  |  | "&&",           null, | 
| 174 |  |  | "or",           new Token(opOr, "or"), | 
| 175 |  |  | ",",            null, | 
| 176 |  |  | "|",            null, | 
| 177 |  |  | "||",            null, | 
| 178 |  |  | "not",          new Token(opNot, "not"), | 
| 179 |  |  | "!",            null, | 
| 180 |  |  | "<",            new Token(opLT, "<"), | 
| 181 |  |  | "<=",           new Token(opLE, "<="), | 
| 182 |  |  | ">=",           new Token(opGE, ">="), | 
| 183 |  |  | ">",            new Token(opGT, ">="), | 
| 184 |  |  | "==",           new Token(opEQ, "=="), | 
| 185 |  |  | "=",            null, | 
| 186 |  |  | "!=",           new Token(opNE, "!="), | 
| 187 |  |  | "<>",           null, | 
| 188 |  |  | "/=",           null, | 
| 189 |  |  | "within",       new Token(within, "within"), | 
| 190 |  |  | "+",            new Token(plus, "+"), | 
| 191 |  |  | "pick",         new Token(pick, "pick"), | 
| 192 |  |  | ".",            new Token(dot, "."), | 
| 193 |  |  | "[",            new Token(leftsquare,  "["), | 
| 194 |  |  | "]",            new Token(rightsquare, "]"), | 
| 195 |  |  | ":",            new Token(colon, ":"), | 
| 196 |  |  | "/",            new Token(slash, "/"), | 
| 197 |  |  |  | 
| 198 |  |  | "atomno",       new Token(atomno, "atomno"), | 
| 199 |  |  | "elemno",       tokenElemno, | 
| 200 |  |  | "_e",           tokenElemno, | 
| 201 |  |  | "resno",        new Token(resno, "resno"), | 
| 202 |  |  | "temperature",  new Token(temperature, "temperature"), | 
| 203 |  |  | "relativetemperature",  null, | 
| 204 |  |  | "_bondedcount", new Token(_bondedcount, "_bondedcount"), | 
| 205 |  |  | "_groupID",     new Token(_groupID, "_groupID"), | 
| 206 |  |  | "_g",           null, | 
| 207 |  |  | "_atomID",      new Token(_atomID, "_atomID"), | 
| 208 |  |  | "_a",           null, | 
| 209 |  |  | "_structure",   new Token(_structure, "_structure"), | 
| 210 |  |  | "occupancy",    new Token(occupancy, "occupancy"), | 
| 211 |  |  | "polymerlength",new Token(polymerLength, "polymerlength"), | 
| 212 |  |  |  | 
| 213 |  |  | "x",            new Token(x, "x"), | 
| 214 |  |  | "y",            new Token(y, "y"), | 
| 215 |  |  | "z",            new Token(z, "z"), | 
| 216 |  |  | "*",            new Token(asterisk, "*"), | 
| 217 |  |  | "all",          tokenAll, | 
| 218 |  |  | "none",         new Token(none, "none"), | 
| 219 |  |  |  | 
| 220 |  |  | }; | 
| 221 |  |  |  | 
| 222 |  |  |  | 
| 223 |  |  | static Hashtable map = new Hashtable(); | 
| 224 |  |  | static { | 
| 225 |  |  | Token tokenLast = null; | 
| 226 |  |  | String stringThis; | 
| 227 |  |  | Token tokenThis; | 
| 228 |  |  | for (int i = 0; i + 1 < arrayPairs.length; i += 2) { | 
| 229 |  |  | stringThis = (String) arrayPairs[i]; | 
| 230 |  |  | tokenThis = (Token) arrayPairs[i + 1]; | 
| 231 |  |  | if (tokenThis == null) | 
| 232 |  |  | tokenThis = tokenLast; | 
| 233 |  |  | if (map.get(stringThis) != null) | 
| 234 |  |  | System.out.println("duplicate token definition:" + stringThis); | 
| 235 |  |  | map.put(stringThis, tokenThis); | 
| 236 |  |  | tokenLast = tokenThis; | 
| 237 |  |  | } | 
| 238 |  |  | } | 
| 239 |  |  |  | 
| 240 |  |  |  | 
| 241 |  |  | }; | 
| 242 |  |  |  | 
| 243 |  |  | } | 
| 244 |  |  |  | 
| 245 |  |  | #endif |