| 1 |
/* $ANTLR 2.7.7 (20141024): "MDTreeParser.g" -> "MDTreeParser.cpp"$ */ |
| 2 |
#include "MDTreeParser.hpp" |
| 3 |
#include <antlr/Token.hpp> |
| 4 |
#include <antlr/AST.hpp> |
| 5 |
#include <antlr/NoViableAltException.hpp> |
| 6 |
#include <antlr/MismatchedTokenException.hpp> |
| 7 |
#include <antlr/SemanticException.hpp> |
| 8 |
#include <antlr/BitSet.hpp> |
| 9 |
#line 1 "MDTreeParser.g" |
| 10 |
#line 11 "MDTreeParser.cpp" |
| 11 |
MDTreeParser::MDTreeParser() |
| 12 |
: ANTLR_USE_NAMESPACE(antlr)TreeParser() { |
| 13 |
} |
| 14 |
|
| 15 |
void MDTreeParser::mdfile(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 16 |
ANTLR_USE_NAMESPACE(antlr)RefAST mdfile_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 17 |
|
| 18 |
try { // for error handling |
| 19 |
{ // ( ... )* |
| 20 |
for (;;) { |
| 21 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 22 |
_t = ASTNULL; |
| 23 |
if ((_tokenSet_0.member(_t->getType()))) { |
| 24 |
statement(_t); |
| 25 |
_t = _retTree; |
| 26 |
} |
| 27 |
else { |
| 28 |
goto _loop3; |
| 29 |
} |
| 30 |
|
| 31 |
} |
| 32 |
_loop3:; |
| 33 |
} // ( ... )* |
| 34 |
#line 34 "MDTreeParser.g" |
| 35 |
blockStack.top()->validate(); blockStack.pop(); |
| 36 |
#line 37 "MDTreeParser.cpp" |
| 37 |
} |
| 38 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 39 |
reportError(ex); |
| 40 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 41 |
_t = _t->getNextSibling(); |
| 42 |
} |
| 43 |
_retTree = _t; |
| 44 |
} |
| 45 |
|
| 46 |
void MDTreeParser::statement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 47 |
ANTLR_USE_NAMESPACE(antlr)RefAST statement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 48 |
|
| 49 |
try { // for error handling |
| 50 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 51 |
_t = ASTNULL; |
| 52 |
switch ( _t->getType()) { |
| 53 |
case ASSIGNEQUAL: |
| 54 |
{ |
| 55 |
assignment(_t); |
| 56 |
_t = _retTree; |
| 57 |
break; |
| 58 |
} |
| 59 |
case COMPONENT: |
| 60 |
{ |
| 61 |
componentblock(_t); |
| 62 |
_t = _retTree; |
| 63 |
break; |
| 64 |
} |
| 65 |
case MOLECULE: |
| 66 |
{ |
| 67 |
moleculeblock(_t); |
| 68 |
_t = _retTree; |
| 69 |
break; |
| 70 |
} |
| 71 |
case ZCONSTRAINT: |
| 72 |
{ |
| 73 |
zconstraintblock(_t); |
| 74 |
_t = _retTree; |
| 75 |
break; |
| 76 |
} |
| 77 |
case RESTRAINT: |
| 78 |
{ |
| 79 |
restraintblock(_t); |
| 80 |
_t = _retTree; |
| 81 |
break; |
| 82 |
} |
| 83 |
case FLUCQ: |
| 84 |
{ |
| 85 |
flucqblock(_t); |
| 86 |
_t = _retTree; |
| 87 |
break; |
| 88 |
} |
| 89 |
case RNEMD: |
| 90 |
{ |
| 91 |
rnemdblock(_t); |
| 92 |
_t = _retTree; |
| 93 |
break; |
| 94 |
} |
| 95 |
case MINIMIZER: |
| 96 |
{ |
| 97 |
minimizerblock(_t); |
| 98 |
_t = _retTree; |
| 99 |
break; |
| 100 |
} |
| 101 |
default: |
| 102 |
{ |
| 103 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 104 |
} |
| 105 |
} |
| 106 |
} |
| 107 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 108 |
reportError(ex); |
| 109 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 110 |
_t = _t->getNextSibling(); |
| 111 |
} |
| 112 |
_retTree = _t; |
| 113 |
} |
| 114 |
|
| 115 |
void MDTreeParser::assignment(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 116 |
ANTLR_USE_NAMESPACE(antlr)RefAST assignment_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 117 |
ANTLR_USE_NAMESPACE(antlr)RefAST id = ANTLR_USE_NAMESPACE(antlr)nullAST; |
| 118 |
|
| 119 |
try { // for error handling |
| 120 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t6 = _t; |
| 121 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp1_AST_in = _t; |
| 122 |
match(_t,ASSIGNEQUAL); |
| 123 |
_t = _t->getFirstChild(); |
| 124 |
id = _t; |
| 125 |
match(_t,ID); |
| 126 |
_t = _t->getNextSibling(); |
| 127 |
constant(_t,id); |
| 128 |
_t = _retTree; |
| 129 |
_t = __t6; |
| 130 |
_t = _t->getNextSibling(); |
| 131 |
} |
| 132 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 133 |
reportError(ex); |
| 134 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 135 |
_t = _t->getNextSibling(); |
| 136 |
} |
| 137 |
_retTree = _t; |
| 138 |
} |
| 139 |
|
| 140 |
void MDTreeParser::componentblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 141 |
ANTLR_USE_NAMESPACE(antlr)RefAST componentblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 142 |
|
| 143 |
try { // for error handling |
| 144 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t10 = _t; |
| 145 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp2_AST_in = _t; |
| 146 |
match(_t,COMPONENT); |
| 147 |
_t = _t->getFirstChild(); |
| 148 |
#line 70 "MDTreeParser.g" |
| 149 |
Component* currComponet = new Component(); blockStack.push(currComponet); |
| 150 |
#line 151 "MDTreeParser.cpp" |
| 151 |
{ // ( ... )* |
| 152 |
for (;;) { |
| 153 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 154 |
_t = ASTNULL; |
| 155 |
if ((_t->getType() == ASSIGNEQUAL)) { |
| 156 |
assignment(_t); |
| 157 |
_t = _retTree; |
| 158 |
} |
| 159 |
else { |
| 160 |
goto _loop12; |
| 161 |
} |
| 162 |
|
| 163 |
} |
| 164 |
_loop12:; |
| 165 |
} // ( ... )* |
| 166 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp3_AST_in = _t; |
| 167 |
match(_t,ENDBLOCK); |
| 168 |
_t = _t->getNextSibling(); |
| 169 |
_t = __t10; |
| 170 |
_t = _t->getNextSibling(); |
| 171 |
#line 72 "MDTreeParser.g" |
| 172 |
blockStack.top()->validate();blockStack.pop(); currConf->addComponent(currComponet); |
| 173 |
#line 174 "MDTreeParser.cpp" |
| 174 |
} |
| 175 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 176 |
reportError(ex); |
| 177 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 178 |
_t = _t->getNextSibling(); |
| 179 |
} |
| 180 |
_retTree = _t; |
| 181 |
} |
| 182 |
|
| 183 |
void MDTreeParser::moleculeblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 184 |
ANTLR_USE_NAMESPACE(antlr)RefAST moleculeblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 185 |
|
| 186 |
try { // for error handling |
| 187 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t34 = _t; |
| 188 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp4_AST_in = _t; |
| 189 |
match(_t,MOLECULE); |
| 190 |
_t = _t->getFirstChild(); |
| 191 |
#line 101 "MDTreeParser.g" |
| 192 |
MoleculeStamp* currMoleculeStamp = new MoleculeStamp(); blockStack.push(currMoleculeStamp); |
| 193 |
#line 194 "MDTreeParser.cpp" |
| 194 |
{ // ( ... )* |
| 195 |
for (;;) { |
| 196 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 197 |
_t = ASTNULL; |
| 198 |
if ((_tokenSet_1.member(_t->getType()))) { |
| 199 |
moleculestatement(_t); |
| 200 |
_t = _retTree; |
| 201 |
} |
| 202 |
else { |
| 203 |
goto _loop36; |
| 204 |
} |
| 205 |
|
| 206 |
} |
| 207 |
_loop36:; |
| 208 |
} // ( ... )* |
| 209 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp5_AST_in = _t; |
| 210 |
match(_t,ENDBLOCK); |
| 211 |
_t = _t->getNextSibling(); |
| 212 |
_t = __t34; |
| 213 |
_t = _t->getNextSibling(); |
| 214 |
#line 103 "MDTreeParser.g" |
| 215 |
blockStack.top()->validate(); blockStack.pop(); currConf->addMoleculeStamp(currMoleculeStamp); |
| 216 |
#line 217 "MDTreeParser.cpp" |
| 217 |
} |
| 218 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 219 |
reportError(ex); |
| 220 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 221 |
_t = _t->getNextSibling(); |
| 222 |
} |
| 223 |
_retTree = _t; |
| 224 |
} |
| 225 |
|
| 226 |
void MDTreeParser::zconstraintblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 227 |
ANTLR_USE_NAMESPACE(antlr)RefAST zconstraintblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 228 |
|
| 229 |
try { // for error handling |
| 230 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t14 = _t; |
| 231 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp6_AST_in = _t; |
| 232 |
match(_t,ZCONSTRAINT); |
| 233 |
_t = _t->getFirstChild(); |
| 234 |
#line 75 "MDTreeParser.g" |
| 235 |
ZConsStamp* currZConsStamp = new ZConsStamp(); blockStack.push(currZConsStamp); |
| 236 |
#line 237 "MDTreeParser.cpp" |
| 237 |
{ // ( ... )* |
| 238 |
for (;;) { |
| 239 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 240 |
_t = ASTNULL; |
| 241 |
if ((_t->getType() == ASSIGNEQUAL)) { |
| 242 |
assignment(_t); |
| 243 |
_t = _retTree; |
| 244 |
} |
| 245 |
else { |
| 246 |
goto _loop16; |
| 247 |
} |
| 248 |
|
| 249 |
} |
| 250 |
_loop16:; |
| 251 |
} // ( ... )* |
| 252 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp7_AST_in = _t; |
| 253 |
match(_t,ENDBLOCK); |
| 254 |
_t = _t->getNextSibling(); |
| 255 |
_t = __t14; |
| 256 |
_t = _t->getNextSibling(); |
| 257 |
#line 77 "MDTreeParser.g" |
| 258 |
blockStack.top()->validate();blockStack.pop(); currConf->addZConsStamp(currZConsStamp); |
| 259 |
#line 260 "MDTreeParser.cpp" |
| 260 |
} |
| 261 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 262 |
reportError(ex); |
| 263 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 264 |
_t = _t->getNextSibling(); |
| 265 |
} |
| 266 |
_retTree = _t; |
| 267 |
} |
| 268 |
|
| 269 |
void MDTreeParser::restraintblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 270 |
ANTLR_USE_NAMESPACE(antlr)RefAST restraintblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 271 |
|
| 272 |
try { // for error handling |
| 273 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t18 = _t; |
| 274 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp8_AST_in = _t; |
| 275 |
match(_t,RESTRAINT); |
| 276 |
_t = _t->getFirstChild(); |
| 277 |
#line 80 "MDTreeParser.g" |
| 278 |
RestraintStamp* currRestraintStamp = new RestraintStamp(); blockStack.push(currRestraintStamp); |
| 279 |
#line 280 "MDTreeParser.cpp" |
| 280 |
{ // ( ... )* |
| 281 |
for (;;) { |
| 282 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 283 |
_t = ASTNULL; |
| 284 |
if ((_t->getType() == ASSIGNEQUAL)) { |
| 285 |
assignment(_t); |
| 286 |
_t = _retTree; |
| 287 |
} |
| 288 |
else { |
| 289 |
goto _loop20; |
| 290 |
} |
| 291 |
|
| 292 |
} |
| 293 |
_loop20:; |
| 294 |
} // ( ... )* |
| 295 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp9_AST_in = _t; |
| 296 |
match(_t,ENDBLOCK); |
| 297 |
_t = _t->getNextSibling(); |
| 298 |
_t = __t18; |
| 299 |
_t = _t->getNextSibling(); |
| 300 |
#line 82 "MDTreeParser.g" |
| 301 |
blockStack.top()->validate();blockStack.pop(); currConf->addRestraintStamp(currRestraintStamp); |
| 302 |
#line 303 "MDTreeParser.cpp" |
| 303 |
} |
| 304 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 305 |
reportError(ex); |
| 306 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 307 |
_t = _t->getNextSibling(); |
| 308 |
} |
| 309 |
_retTree = _t; |
| 310 |
} |
| 311 |
|
| 312 |
void MDTreeParser::flucqblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 313 |
ANTLR_USE_NAMESPACE(antlr)RefAST flucqblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 314 |
|
| 315 |
try { // for error handling |
| 316 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t22 = _t; |
| 317 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp10_AST_in = _t; |
| 318 |
match(_t,FLUCQ); |
| 319 |
_t = _t->getFirstChild(); |
| 320 |
#line 85 "MDTreeParser.g" |
| 321 |
FluctuatingChargeParameters* flucQpars = new FluctuatingChargeParameters(); blockStack.push(flucQpars); |
| 322 |
#line 323 "MDTreeParser.cpp" |
| 323 |
{ // ( ... )* |
| 324 |
for (;;) { |
| 325 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 326 |
_t = ASTNULL; |
| 327 |
if ((_t->getType() == ASSIGNEQUAL)) { |
| 328 |
assignment(_t); |
| 329 |
_t = _retTree; |
| 330 |
} |
| 331 |
else { |
| 332 |
goto _loop24; |
| 333 |
} |
| 334 |
|
| 335 |
} |
| 336 |
_loop24:; |
| 337 |
} // ( ... )* |
| 338 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp11_AST_in = _t; |
| 339 |
match(_t,ENDBLOCK); |
| 340 |
_t = _t->getNextSibling(); |
| 341 |
_t = __t22; |
| 342 |
_t = _t->getNextSibling(); |
| 343 |
#line 87 "MDTreeParser.g" |
| 344 |
blockStack.top()->validate();blockStack.pop(); currConf->addFluctuatingChargeParameters(flucQpars); |
| 345 |
#line 346 "MDTreeParser.cpp" |
| 346 |
} |
| 347 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 348 |
reportError(ex); |
| 349 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 350 |
_t = _t->getNextSibling(); |
| 351 |
} |
| 352 |
_retTree = _t; |
| 353 |
} |
| 354 |
|
| 355 |
void MDTreeParser::rnemdblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 356 |
ANTLR_USE_NAMESPACE(antlr)RefAST rnemdblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 357 |
|
| 358 |
try { // for error handling |
| 359 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t26 = _t; |
| 360 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp12_AST_in = _t; |
| 361 |
match(_t,RNEMD); |
| 362 |
_t = _t->getFirstChild(); |
| 363 |
#line 90 "MDTreeParser.g" |
| 364 |
RNEMDParameters* rnemdPars = new RNEMDParameters(); blockStack.push(rnemdPars); |
| 365 |
#line 366 "MDTreeParser.cpp" |
| 366 |
{ // ( ... )* |
| 367 |
for (;;) { |
| 368 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 369 |
_t = ASTNULL; |
| 370 |
if ((_t->getType() == ASSIGNEQUAL)) { |
| 371 |
assignment(_t); |
| 372 |
_t = _retTree; |
| 373 |
} |
| 374 |
else { |
| 375 |
goto _loop28; |
| 376 |
} |
| 377 |
|
| 378 |
} |
| 379 |
_loop28:; |
| 380 |
} // ( ... )* |
| 381 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp13_AST_in = _t; |
| 382 |
match(_t,ENDBLOCK); |
| 383 |
_t = _t->getNextSibling(); |
| 384 |
_t = __t26; |
| 385 |
_t = _t->getNextSibling(); |
| 386 |
#line 92 "MDTreeParser.g" |
| 387 |
blockStack.top()->validate();blockStack.pop(); currConf->addRNEMDParameters(rnemdPars); |
| 388 |
#line 389 "MDTreeParser.cpp" |
| 389 |
} |
| 390 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 391 |
reportError(ex); |
| 392 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 393 |
_t = _t->getNextSibling(); |
| 394 |
} |
| 395 |
_retTree = _t; |
| 396 |
} |
| 397 |
|
| 398 |
void MDTreeParser::minimizerblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 399 |
ANTLR_USE_NAMESPACE(antlr)RefAST minimizerblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 400 |
|
| 401 |
try { // for error handling |
| 402 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t30 = _t; |
| 403 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp14_AST_in = _t; |
| 404 |
match(_t,MINIMIZER); |
| 405 |
_t = _t->getFirstChild(); |
| 406 |
#line 95 "MDTreeParser.g" |
| 407 |
MinimizerParameters* minimizerPars = new MinimizerParameters(); blockStack.push(minimizerPars); |
| 408 |
#line 409 "MDTreeParser.cpp" |
| 409 |
{ // ( ... )* |
| 410 |
for (;;) { |
| 411 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 412 |
_t = ASTNULL; |
| 413 |
if ((_t->getType() == ASSIGNEQUAL)) { |
| 414 |
assignment(_t); |
| 415 |
_t = _retTree; |
| 416 |
} |
| 417 |
else { |
| 418 |
goto _loop32; |
| 419 |
} |
| 420 |
|
| 421 |
} |
| 422 |
_loop32:; |
| 423 |
} // ( ... )* |
| 424 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp15_AST_in = _t; |
| 425 |
match(_t,ENDBLOCK); |
| 426 |
_t = _t->getNextSibling(); |
| 427 |
_t = __t30; |
| 428 |
_t = _t->getNextSibling(); |
| 429 |
#line 97 "MDTreeParser.g" |
| 430 |
blockStack.top()->validate();blockStack.pop(); currConf->addMinimizerParameters(minimizerPars); |
| 431 |
#line 432 "MDTreeParser.cpp" |
| 432 |
} |
| 433 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 434 |
reportError(ex); |
| 435 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 436 |
_t = _t->getNextSibling(); |
| 437 |
} |
| 438 |
_retTree = _t; |
| 439 |
} |
| 440 |
|
| 441 |
void MDTreeParser::constant(ANTLR_USE_NAMESPACE(antlr)RefAST _t, |
| 442 |
ANTLR_USE_NAMESPACE(antlr)RefAST id |
| 443 |
) { |
| 444 |
ANTLR_USE_NAMESPACE(antlr)RefAST constant_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 445 |
ANTLR_USE_NAMESPACE(antlr)RefAST str1 = ANTLR_USE_NAMESPACE(antlr)nullAST; |
| 446 |
ANTLR_USE_NAMESPACE(antlr)RefAST str2 = ANTLR_USE_NAMESPACE(antlr)nullAST; |
| 447 |
#line 50 "MDTreeParser.g" |
| 448 |
|
| 449 |
int ival; |
| 450 |
RealType dval, x, y, z; |
| 451 |
std::vector<RealType> dvec; |
| 452 |
|
| 453 |
#line 454 "MDTreeParser.cpp" |
| 454 |
|
| 455 |
try { // for error handling |
| 456 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 457 |
_t = ASTNULL; |
| 458 |
switch ( _t->getType()) { |
| 459 |
case NUM_INT: |
| 460 |
case NUM_LONG: |
| 461 |
{ |
| 462 |
ival=intConst(_t); |
| 463 |
_t = _retTree; |
| 464 |
#line 56 "MDTreeParser.g" |
| 465 |
blockStack.top()->assign(id->getText(), ival); |
| 466 |
#line 467 "MDTreeParser.cpp" |
| 467 |
break; |
| 468 |
} |
| 469 |
case NUM_FLOAT: |
| 470 |
case NUM_DOUBLE: |
| 471 |
{ |
| 472 |
dval=floatConst(_t); |
| 473 |
_t = _retTree; |
| 474 |
#line 57 "MDTreeParser.g" |
| 475 |
blockStack.top()->assign(id->getText(), dval); |
| 476 |
#line 477 "MDTreeParser.cpp" |
| 477 |
break; |
| 478 |
} |
| 479 |
case ID: |
| 480 |
{ |
| 481 |
str1 = _t; |
| 482 |
match(_t,ID); |
| 483 |
_t = _t->getNextSibling(); |
| 484 |
#line 58 "MDTreeParser.g" |
| 485 |
blockStack.top()->assign(id->getText(), str1->getText()); |
| 486 |
#line 487 "MDTreeParser.cpp" |
| 487 |
break; |
| 488 |
} |
| 489 |
case StringLiteral: |
| 490 |
{ |
| 491 |
str2 = _t; |
| 492 |
match(_t,StringLiteral); |
| 493 |
_t = _t->getNextSibling(); |
| 494 |
#line 59 "MDTreeParser.g" |
| 495 |
std::string s = str2->getText(); |
| 496 |
s = s.substr(1, s.length()-2); |
| 497 |
blockStack.top()->assign(id->getText(),s); |
| 498 |
|
| 499 |
#line 500 "MDTreeParser.cpp" |
| 500 |
break; |
| 501 |
} |
| 502 |
case LPAREN: |
| 503 |
{ |
| 504 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t8 = _t; |
| 505 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp16_AST_in = _t; |
| 506 |
match(_t,LPAREN); |
| 507 |
_t = _t->getFirstChild(); |
| 508 |
dvec=doubleNumberTuple(_t); |
| 509 |
_t = _retTree; |
| 510 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp17_AST_in = _t; |
| 511 |
match(_t,RPAREN); |
| 512 |
_t = _t->getNextSibling(); |
| 513 |
_t = __t8; |
| 514 |
_t = _t->getNextSibling(); |
| 515 |
#line 64 "MDTreeParser.g" |
| 516 |
|
| 517 |
blockStack.top()->assign(id->getText(), dvec); |
| 518 |
|
| 519 |
#line 520 "MDTreeParser.cpp" |
| 520 |
break; |
| 521 |
} |
| 522 |
default: |
| 523 |
{ |
| 524 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 525 |
} |
| 526 |
} |
| 527 |
} |
| 528 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 529 |
reportError(ex); |
| 530 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 531 |
_t = _t->getNextSibling(); |
| 532 |
} |
| 533 |
_retTree = _t; |
| 534 |
} |
| 535 |
|
| 536 |
int MDTreeParser::intConst(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 537 |
#line 349 "MDTreeParser.g" |
| 538 |
int ival; |
| 539 |
#line 540 "MDTreeParser.cpp" |
| 540 |
ANTLR_USE_NAMESPACE(antlr)RefAST intConst_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 541 |
ANTLR_USE_NAMESPACE(antlr)RefAST i1 = ANTLR_USE_NAMESPACE(antlr)nullAST; |
| 542 |
ANTLR_USE_NAMESPACE(antlr)RefAST i2 = ANTLR_USE_NAMESPACE(antlr)nullAST; |
| 543 |
|
| 544 |
try { // for error handling |
| 545 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 546 |
_t = ASTNULL; |
| 547 |
switch ( _t->getType()) { |
| 548 |
case NUM_INT: |
| 549 |
{ |
| 550 |
i1 = _t; |
| 551 |
match(_t,NUM_INT); |
| 552 |
_t = _t->getNextSibling(); |
| 553 |
#line 350 "MDTreeParser.g" |
| 554 |
ival = lexi_cast<int>(i1->getText()); |
| 555 |
#line 556 "MDTreeParser.cpp" |
| 556 |
break; |
| 557 |
} |
| 558 |
case NUM_LONG: |
| 559 |
{ |
| 560 |
i2 = _t; |
| 561 |
match(_t,NUM_LONG); |
| 562 |
_t = _t->getNextSibling(); |
| 563 |
#line 351 "MDTreeParser.g" |
| 564 |
ival = lexi_cast<int>(i2->getText()); |
| 565 |
#line 566 "MDTreeParser.cpp" |
| 566 |
break; |
| 567 |
} |
| 568 |
default: |
| 569 |
{ |
| 570 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 571 |
} |
| 572 |
} |
| 573 |
} |
| 574 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 575 |
reportError(ex); |
| 576 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 577 |
_t = _t->getNextSibling(); |
| 578 |
} |
| 579 |
_retTree = _t; |
| 580 |
return ival; |
| 581 |
} |
| 582 |
|
| 583 |
RealType MDTreeParser::floatConst(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 584 |
#line 361 "MDTreeParser.g" |
| 585 |
RealType dval; |
| 586 |
#line 587 "MDTreeParser.cpp" |
| 587 |
ANTLR_USE_NAMESPACE(antlr)RefAST floatConst_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 588 |
ANTLR_USE_NAMESPACE(antlr)RefAST d1 = ANTLR_USE_NAMESPACE(antlr)nullAST; |
| 589 |
ANTLR_USE_NAMESPACE(antlr)RefAST d2 = ANTLR_USE_NAMESPACE(antlr)nullAST; |
| 590 |
|
| 591 |
try { // for error handling |
| 592 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 593 |
_t = ASTNULL; |
| 594 |
switch ( _t->getType()) { |
| 595 |
case NUM_FLOAT: |
| 596 |
{ |
| 597 |
d1 = _t; |
| 598 |
match(_t,NUM_FLOAT); |
| 599 |
_t = _t->getNextSibling(); |
| 600 |
#line 362 "MDTreeParser.g" |
| 601 |
dval = lexi_cast<RealType>(d1->getText()); |
| 602 |
#line 603 "MDTreeParser.cpp" |
| 603 |
break; |
| 604 |
} |
| 605 |
case NUM_DOUBLE: |
| 606 |
{ |
| 607 |
d2 = _t; |
| 608 |
match(_t,NUM_DOUBLE); |
| 609 |
_t = _t->getNextSibling(); |
| 610 |
#line 363 "MDTreeParser.g" |
| 611 |
dval = lexi_cast<RealType>(d2->getText()); |
| 612 |
#line 613 "MDTreeParser.cpp" |
| 613 |
break; |
| 614 |
} |
| 615 |
default: |
| 616 |
{ |
| 617 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 618 |
} |
| 619 |
} |
| 620 |
} |
| 621 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 622 |
reportError(ex); |
| 623 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 624 |
_t = _t->getNextSibling(); |
| 625 |
} |
| 626 |
_retTree = _t; |
| 627 |
return dval; |
| 628 |
} |
| 629 |
|
| 630 |
vector<RealType> MDTreeParser::doubleNumberTuple(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 631 |
#line 333 "MDTreeParser.g" |
| 632 |
vector<RealType> dvec; |
| 633 |
#line 634 "MDTreeParser.cpp" |
| 634 |
ANTLR_USE_NAMESPACE(antlr)RefAST doubleNumberTuple_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 635 |
#line 333 "MDTreeParser.g" |
| 636 |
|
| 637 |
RealType dval; |
| 638 |
|
| 639 |
#line 640 "MDTreeParser.cpp" |
| 640 |
|
| 641 |
try { // for error handling |
| 642 |
{ // ( ... )+ |
| 643 |
int _cnt122=0; |
| 644 |
for (;;) { |
| 645 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 646 |
_t = ASTNULL; |
| 647 |
if (((_t->getType() >= NUM_INT && _t->getType() <= NUM_DOUBLE))) { |
| 648 |
dval=doubleNumber(_t); |
| 649 |
_t = _retTree; |
| 650 |
#line 337 "MDTreeParser.g" |
| 651 |
dvec.push_back(dval); |
| 652 |
#line 653 "MDTreeParser.cpp" |
| 653 |
} |
| 654 |
else { |
| 655 |
if ( _cnt122>=1 ) { goto _loop122; } else {throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t);} |
| 656 |
} |
| 657 |
|
| 658 |
_cnt122++; |
| 659 |
} |
| 660 |
_loop122:; |
| 661 |
} // ( ... )+ |
| 662 |
} |
| 663 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 664 |
reportError(ex); |
| 665 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 666 |
_t = _t->getNextSibling(); |
| 667 |
} |
| 668 |
_retTree = _t; |
| 669 |
return dvec; |
| 670 |
} |
| 671 |
|
| 672 |
void MDTreeParser::moleculestatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 673 |
ANTLR_USE_NAMESPACE(antlr)RefAST moleculestatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 674 |
|
| 675 |
try { // for error handling |
| 676 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 677 |
_t = ASTNULL; |
| 678 |
switch ( _t->getType()) { |
| 679 |
case ASSIGNEQUAL: |
| 680 |
{ |
| 681 |
assignment(_t); |
| 682 |
_t = _retTree; |
| 683 |
break; |
| 684 |
} |
| 685 |
case ATOM: |
| 686 |
{ |
| 687 |
atomblock(_t); |
| 688 |
_t = _retTree; |
| 689 |
break; |
| 690 |
} |
| 691 |
case BOND: |
| 692 |
{ |
| 693 |
bondblock(_t); |
| 694 |
_t = _retTree; |
| 695 |
break; |
| 696 |
} |
| 697 |
case BEND: |
| 698 |
{ |
| 699 |
bendblock(_t); |
| 700 |
_t = _retTree; |
| 701 |
break; |
| 702 |
} |
| 703 |
case TORSION: |
| 704 |
{ |
| 705 |
torsionblock(_t); |
| 706 |
_t = _retTree; |
| 707 |
break; |
| 708 |
} |
| 709 |
case INVERSION: |
| 710 |
{ |
| 711 |
inversionblock(_t); |
| 712 |
_t = _retTree; |
| 713 |
break; |
| 714 |
} |
| 715 |
case RIGIDBODY: |
| 716 |
{ |
| 717 |
rigidbodyblock(_t); |
| 718 |
_t = _retTree; |
| 719 |
break; |
| 720 |
} |
| 721 |
case CUTOFFGROUP: |
| 722 |
{ |
| 723 |
cutoffgroupblock(_t); |
| 724 |
_t = _retTree; |
| 725 |
break; |
| 726 |
} |
| 727 |
case FRAGMENT: |
| 728 |
{ |
| 729 |
fragmentblock(_t); |
| 730 |
_t = _retTree; |
| 731 |
break; |
| 732 |
} |
| 733 |
case CONSTRAINT: |
| 734 |
{ |
| 735 |
constraintblock(_t); |
| 736 |
_t = _retTree; |
| 737 |
break; |
| 738 |
} |
| 739 |
default: |
| 740 |
{ |
| 741 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 742 |
} |
| 743 |
} |
| 744 |
} |
| 745 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 746 |
reportError(ex); |
| 747 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 748 |
_t = _t->getNextSibling(); |
| 749 |
} |
| 750 |
_retTree = _t; |
| 751 |
} |
| 752 |
|
| 753 |
void MDTreeParser::atomblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 754 |
ANTLR_USE_NAMESPACE(antlr)RefAST atomblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 755 |
#line 118 "MDTreeParser.g" |
| 756 |
|
| 757 |
int index; |
| 758 |
|
| 759 |
#line 760 "MDTreeParser.cpp" |
| 760 |
|
| 761 |
try { // for error handling |
| 762 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t39 = _t; |
| 763 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp18_AST_in = _t; |
| 764 |
match(_t,ATOM); |
| 765 |
_t = _t->getFirstChild(); |
| 766 |
index=intConst(_t); |
| 767 |
_t = _retTree; |
| 768 |
#line 122 "MDTreeParser.g" |
| 769 |
AtomStamp* currAtomStamp = new AtomStamp(index); blockStack.push(currAtomStamp); |
| 770 |
#line 771 "MDTreeParser.cpp" |
| 771 |
{ // ( ... )* |
| 772 |
for (;;) { |
| 773 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 774 |
_t = ASTNULL; |
| 775 |
if ((_tokenSet_2.member(_t->getType()))) { |
| 776 |
atomstatement(_t); |
| 777 |
_t = _retTree; |
| 778 |
} |
| 779 |
else { |
| 780 |
goto _loop41; |
| 781 |
} |
| 782 |
|
| 783 |
} |
| 784 |
_loop41:; |
| 785 |
} // ( ... )* |
| 786 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp19_AST_in = _t; |
| 787 |
match(_t,ENDBLOCK); |
| 788 |
_t = _t->getNextSibling(); |
| 789 |
_t = __t39; |
| 790 |
_t = _t->getNextSibling(); |
| 791 |
#line 124 "MDTreeParser.g" |
| 792 |
|
| 793 |
blockStack.top()->validate(); |
| 794 |
blockStack.pop(); |
| 795 |
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
| 796 |
currMoleculeStamp->addAtomStamp(currAtomStamp); |
| 797 |
|
| 798 |
#line 799 "MDTreeParser.cpp" |
| 799 |
} |
| 800 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 801 |
reportError(ex); |
| 802 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 803 |
_t = _t->getNextSibling(); |
| 804 |
} |
| 805 |
_retTree = _t; |
| 806 |
} |
| 807 |
|
| 808 |
void MDTreeParser::bondblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 809 |
ANTLR_USE_NAMESPACE(antlr)RefAST bondblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 810 |
|
| 811 |
try { // for error handling |
| 812 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t47 = _t; |
| 813 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp20_AST_in = _t; |
| 814 |
match(_t,BOND); |
| 815 |
_t = _t->getFirstChild(); |
| 816 |
#line 147 "MDTreeParser.g" |
| 817 |
BondStamp* currBondStamp = new BondStamp(); blockStack.push(currBondStamp); |
| 818 |
#line 819 "MDTreeParser.cpp" |
| 819 |
{ // ( ... )* |
| 820 |
for (;;) { |
| 821 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 822 |
_t = ASTNULL; |
| 823 |
if ((_tokenSet_3.member(_t->getType()))) { |
| 824 |
bondstatement(_t); |
| 825 |
_t = _retTree; |
| 826 |
} |
| 827 |
else { |
| 828 |
goto _loop49; |
| 829 |
} |
| 830 |
|
| 831 |
} |
| 832 |
_loop49:; |
| 833 |
} // ( ... )* |
| 834 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp21_AST_in = _t; |
| 835 |
match(_t,ENDBLOCK); |
| 836 |
_t = _t->getNextSibling(); |
| 837 |
_t = __t47; |
| 838 |
_t = _t->getNextSibling(); |
| 839 |
#line 149 "MDTreeParser.g" |
| 840 |
|
| 841 |
blockStack.top()->validate(); |
| 842 |
blockStack.pop(); |
| 843 |
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
| 844 |
currMoleculeStamp->addBondStamp(currBondStamp); |
| 845 |
|
| 846 |
#line 847 "MDTreeParser.cpp" |
| 847 |
} |
| 848 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 849 |
reportError(ex); |
| 850 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 851 |
_t = _t->getNextSibling(); |
| 852 |
} |
| 853 |
_retTree = _t; |
| 854 |
} |
| 855 |
|
| 856 |
void MDTreeParser::bendblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 857 |
ANTLR_USE_NAMESPACE(antlr)RefAST bendblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 858 |
|
| 859 |
try { // for error handling |
| 860 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t59 = _t; |
| 861 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp22_AST_in = _t; |
| 862 |
match(_t,BEND); |
| 863 |
_t = _t->getFirstChild(); |
| 864 |
#line 174 "MDTreeParser.g" |
| 865 |
BendStamp* currBendStamp = new BendStamp(); blockStack.push(currBendStamp); |
| 866 |
#line 867 "MDTreeParser.cpp" |
| 867 |
{ // ( ... )* |
| 868 |
for (;;) { |
| 869 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 870 |
_t = ASTNULL; |
| 871 |
if ((_tokenSet_4.member(_t->getType()))) { |
| 872 |
bendstatement(_t); |
| 873 |
_t = _retTree; |
| 874 |
} |
| 875 |
else { |
| 876 |
goto _loop61; |
| 877 |
} |
| 878 |
|
| 879 |
} |
| 880 |
_loop61:; |
| 881 |
} // ( ... )* |
| 882 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp23_AST_in = _t; |
| 883 |
match(_t,ENDBLOCK); |
| 884 |
_t = _t->getNextSibling(); |
| 885 |
_t = __t59; |
| 886 |
_t = _t->getNextSibling(); |
| 887 |
#line 176 "MDTreeParser.g" |
| 888 |
|
| 889 |
blockStack.top()->validate(); |
| 890 |
blockStack.pop(); |
| 891 |
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
| 892 |
currMoleculeStamp->addBendStamp(currBendStamp); |
| 893 |
|
| 894 |
#line 895 "MDTreeParser.cpp" |
| 895 |
} |
| 896 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 897 |
reportError(ex); |
| 898 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 899 |
_t = _t->getNextSibling(); |
| 900 |
} |
| 901 |
_retTree = _t; |
| 902 |
} |
| 903 |
|
| 904 |
void MDTreeParser::torsionblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 905 |
ANTLR_USE_NAMESPACE(antlr)RefAST torsionblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 906 |
|
| 907 |
try { // for error handling |
| 908 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t72 = _t; |
| 909 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp24_AST_in = _t; |
| 910 |
match(_t,TORSION); |
| 911 |
_t = _t->getFirstChild(); |
| 912 |
#line 201 "MDTreeParser.g" |
| 913 |
TorsionStamp* currTorsionStamp = new TorsionStamp(); blockStack.push(currTorsionStamp); |
| 914 |
#line 915 "MDTreeParser.cpp" |
| 915 |
{ // ( ... )* |
| 916 |
for (;;) { |
| 917 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 918 |
_t = ASTNULL; |
| 919 |
if ((_tokenSet_5.member(_t->getType()))) { |
| 920 |
torsionstatement(_t); |
| 921 |
_t = _retTree; |
| 922 |
} |
| 923 |
else { |
| 924 |
goto _loop74; |
| 925 |
} |
| 926 |
|
| 927 |
} |
| 928 |
_loop74:; |
| 929 |
} // ( ... )* |
| 930 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp25_AST_in = _t; |
| 931 |
match(_t,ENDBLOCK); |
| 932 |
_t = _t->getNextSibling(); |
| 933 |
_t = __t72; |
| 934 |
_t = _t->getNextSibling(); |
| 935 |
#line 203 "MDTreeParser.g" |
| 936 |
|
| 937 |
blockStack.top()->validate(); |
| 938 |
blockStack.pop(); |
| 939 |
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
| 940 |
currMoleculeStamp->addTorsionStamp(currTorsionStamp); |
| 941 |
|
| 942 |
#line 943 "MDTreeParser.cpp" |
| 943 |
} |
| 944 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 945 |
reportError(ex); |
| 946 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 947 |
_t = _t->getNextSibling(); |
| 948 |
} |
| 949 |
_retTree = _t; |
| 950 |
} |
| 951 |
|
| 952 |
void MDTreeParser::inversionblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 953 |
ANTLR_USE_NAMESPACE(antlr)RefAST inversionblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 954 |
|
| 955 |
try { // for error handling |
| 956 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t86 = _t; |
| 957 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp26_AST_in = _t; |
| 958 |
match(_t,INVERSION); |
| 959 |
_t = _t->getFirstChild(); |
| 960 |
#line 230 "MDTreeParser.g" |
| 961 |
InversionStamp* currInversionStamp = new InversionStamp(); blockStack.push(currInversionStamp); |
| 962 |
#line 963 "MDTreeParser.cpp" |
| 963 |
{ // ( ... )* |
| 964 |
for (;;) { |
| 965 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 966 |
_t = ASTNULL; |
| 967 |
if ((_tokenSet_6.member(_t->getType()))) { |
| 968 |
inversionstatement(_t); |
| 969 |
_t = _retTree; |
| 970 |
} |
| 971 |
else { |
| 972 |
goto _loop88; |
| 973 |
} |
| 974 |
|
| 975 |
} |
| 976 |
_loop88:; |
| 977 |
} // ( ... )* |
| 978 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp27_AST_in = _t; |
| 979 |
match(_t,ENDBLOCK); |
| 980 |
_t = _t->getNextSibling(); |
| 981 |
_t = __t86; |
| 982 |
_t = _t->getNextSibling(); |
| 983 |
#line 232 "MDTreeParser.g" |
| 984 |
|
| 985 |
blockStack.top()->validate(); |
| 986 |
blockStack.pop(); |
| 987 |
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
| 988 |
currMoleculeStamp->addInversionStamp(currInversionStamp); |
| 989 |
|
| 990 |
#line 991 "MDTreeParser.cpp" |
| 991 |
} |
| 992 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 993 |
reportError(ex); |
| 994 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 995 |
_t = _t->getNextSibling(); |
| 996 |
} |
| 997 |
_retTree = _t; |
| 998 |
} |
| 999 |
|
| 1000 |
void MDTreeParser::rigidbodyblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1001 |
ANTLR_USE_NAMESPACE(antlr)RefAST rigidbodyblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1002 |
#line 258 "MDTreeParser.g" |
| 1003 |
|
| 1004 |
int index; |
| 1005 |
|
| 1006 |
#line 1007 "MDTreeParser.cpp" |
| 1007 |
|
| 1008 |
try { // for error handling |
| 1009 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t98 = _t; |
| 1010 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp28_AST_in = _t; |
| 1011 |
match(_t,RIGIDBODY); |
| 1012 |
_t = _t->getFirstChild(); |
| 1013 |
index=intConst(_t); |
| 1014 |
_t = _retTree; |
| 1015 |
#line 262 "MDTreeParser.g" |
| 1016 |
RigidBodyStamp* currRigidBodyStamp = new RigidBodyStamp(index); blockStack.push(currRigidBodyStamp); |
| 1017 |
#line 1018 "MDTreeParser.cpp" |
| 1018 |
{ // ( ... )* |
| 1019 |
for (;;) { |
| 1020 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1021 |
_t = ASTNULL; |
| 1022 |
if ((_t->getType() == MEMBERS || _t->getType() == ASSIGNEQUAL)) { |
| 1023 |
rigidbodystatement(_t); |
| 1024 |
_t = _retTree; |
| 1025 |
} |
| 1026 |
else { |
| 1027 |
goto _loop100; |
| 1028 |
} |
| 1029 |
|
| 1030 |
} |
| 1031 |
_loop100:; |
| 1032 |
} // ( ... )* |
| 1033 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp29_AST_in = _t; |
| 1034 |
match(_t,ENDBLOCK); |
| 1035 |
_t = _t->getNextSibling(); |
| 1036 |
_t = __t98; |
| 1037 |
_t = _t->getNextSibling(); |
| 1038 |
#line 264 "MDTreeParser.g" |
| 1039 |
|
| 1040 |
blockStack.top()->validate(); |
| 1041 |
blockStack.pop(); |
| 1042 |
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
| 1043 |
currMoleculeStamp->addRigidBodyStamp(currRigidBodyStamp); |
| 1044 |
|
| 1045 |
#line 1046 "MDTreeParser.cpp" |
| 1046 |
} |
| 1047 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1048 |
reportError(ex); |
| 1049 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1050 |
_t = _t->getNextSibling(); |
| 1051 |
} |
| 1052 |
_retTree = _t; |
| 1053 |
} |
| 1054 |
|
| 1055 |
void MDTreeParser::cutoffgroupblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1056 |
ANTLR_USE_NAMESPACE(antlr)RefAST cutoffgroupblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1057 |
|
| 1058 |
try { // for error handling |
| 1059 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t104 = _t; |
| 1060 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp30_AST_in = _t; |
| 1061 |
match(_t,CUTOFFGROUP); |
| 1062 |
_t = _t->getFirstChild(); |
| 1063 |
#line 281 "MDTreeParser.g" |
| 1064 |
CutoffGroupStamp* currCutoffGroupStamp = new CutoffGroupStamp(); blockStack.push(currCutoffGroupStamp); |
| 1065 |
#line 1066 "MDTreeParser.cpp" |
| 1066 |
{ // ( ... )* |
| 1067 |
for (;;) { |
| 1068 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1069 |
_t = ASTNULL; |
| 1070 |
if ((_t->getType() == MEMBERS || _t->getType() == ASSIGNEQUAL)) { |
| 1071 |
cutoffgroupstatement(_t); |
| 1072 |
_t = _retTree; |
| 1073 |
} |
| 1074 |
else { |
| 1075 |
goto _loop106; |
| 1076 |
} |
| 1077 |
|
| 1078 |
} |
| 1079 |
_loop106:; |
| 1080 |
} // ( ... )* |
| 1081 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp31_AST_in = _t; |
| 1082 |
match(_t,ENDBLOCK); |
| 1083 |
_t = _t->getNextSibling(); |
| 1084 |
_t = __t104; |
| 1085 |
_t = _t->getNextSibling(); |
| 1086 |
#line 283 "MDTreeParser.g" |
| 1087 |
|
| 1088 |
blockStack.top()->validate(); |
| 1089 |
blockStack.pop(); |
| 1090 |
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
| 1091 |
currMoleculeStamp->addCutoffGroupStamp(currCutoffGroupStamp); |
| 1092 |
|
| 1093 |
#line 1094 "MDTreeParser.cpp" |
| 1094 |
} |
| 1095 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1096 |
reportError(ex); |
| 1097 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1098 |
_t = _t->getNextSibling(); |
| 1099 |
} |
| 1100 |
_retTree = _t; |
| 1101 |
} |
| 1102 |
|
| 1103 |
void MDTreeParser::fragmentblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1104 |
ANTLR_USE_NAMESPACE(antlr)RefAST fragmentblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1105 |
#line 300 "MDTreeParser.g" |
| 1106 |
int ival; |
| 1107 |
#line 1108 "MDTreeParser.cpp" |
| 1108 |
|
| 1109 |
try { // for error handling |
| 1110 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t110 = _t; |
| 1111 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp32_AST_in = _t; |
| 1112 |
match(_t,FRAGMENT); |
| 1113 |
_t = _t->getFirstChild(); |
| 1114 |
ival=intConst(_t); |
| 1115 |
_t = _retTree; |
| 1116 |
#line 301 "MDTreeParser.g" |
| 1117 |
FragmentStamp* currFragmentStamp = new FragmentStamp(ival); blockStack.push(currFragmentStamp); |
| 1118 |
#line 1119 "MDTreeParser.cpp" |
| 1119 |
{ // ( ... )* |
| 1120 |
for (;;) { |
| 1121 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1122 |
_t = ASTNULL; |
| 1123 |
if ((_t->getType() == ASSIGNEQUAL)) { |
| 1124 |
fragmentstatement(_t); |
| 1125 |
_t = _retTree; |
| 1126 |
} |
| 1127 |
else { |
| 1128 |
goto _loop112; |
| 1129 |
} |
| 1130 |
|
| 1131 |
} |
| 1132 |
_loop112:; |
| 1133 |
} // ( ... )* |
| 1134 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp33_AST_in = _t; |
| 1135 |
match(_t,ENDBLOCK); |
| 1136 |
_t = _t->getNextSibling(); |
| 1137 |
_t = __t110; |
| 1138 |
_t = _t->getNextSibling(); |
| 1139 |
#line 303 "MDTreeParser.g" |
| 1140 |
|
| 1141 |
blockStack.top()->validate(); |
| 1142 |
blockStack.pop(); |
| 1143 |
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
| 1144 |
currMoleculeStamp->addFragmentStamp(currFragmentStamp); |
| 1145 |
|
| 1146 |
#line 1147 "MDTreeParser.cpp" |
| 1147 |
} |
| 1148 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1149 |
reportError(ex); |
| 1150 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1151 |
_t = _t->getNextSibling(); |
| 1152 |
} |
| 1153 |
_retTree = _t; |
| 1154 |
} |
| 1155 |
|
| 1156 |
void MDTreeParser::constraintblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1157 |
ANTLR_USE_NAMESPACE(antlr)RefAST constraintblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1158 |
|
| 1159 |
try { // for error handling |
| 1160 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t115 = _t; |
| 1161 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp34_AST_in = _t; |
| 1162 |
match(_t,CONSTRAINT); |
| 1163 |
_t = _t->getFirstChild(); |
| 1164 |
#line 314 "MDTreeParser.g" |
| 1165 |
ConstraintStamp* currConstraintStamp = new ConstraintStamp(); blockStack.push(currConstraintStamp); |
| 1166 |
#line 1167 "MDTreeParser.cpp" |
| 1167 |
{ // ( ... )* |
| 1168 |
for (;;) { |
| 1169 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1170 |
_t = ASTNULL; |
| 1171 |
if ((_t->getType() == MEMBERS || _t->getType() == ASSIGNEQUAL)) { |
| 1172 |
constraintstatement(_t); |
| 1173 |
_t = _retTree; |
| 1174 |
} |
| 1175 |
else { |
| 1176 |
goto _loop117; |
| 1177 |
} |
| 1178 |
|
| 1179 |
} |
| 1180 |
_loop117:; |
| 1181 |
} // ( ... )* |
| 1182 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp35_AST_in = _t; |
| 1183 |
match(_t,ENDBLOCK); |
| 1184 |
_t = _t->getNextSibling(); |
| 1185 |
_t = __t115; |
| 1186 |
_t = _t->getNextSibling(); |
| 1187 |
#line 316 "MDTreeParser.g" |
| 1188 |
|
| 1189 |
blockStack.pop(); |
| 1190 |
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
| 1191 |
currMoleculeStamp->addConstraintStamp(currConstraintStamp); |
| 1192 |
|
| 1193 |
#line 1194 "MDTreeParser.cpp" |
| 1194 |
} |
| 1195 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1196 |
reportError(ex); |
| 1197 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1198 |
_t = _t->getNextSibling(); |
| 1199 |
} |
| 1200 |
_retTree = _t; |
| 1201 |
} |
| 1202 |
|
| 1203 |
void MDTreeParser::atomstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1204 |
ANTLR_USE_NAMESPACE(antlr)RefAST atomstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1205 |
#line 132 "MDTreeParser.g" |
| 1206 |
|
| 1207 |
vector<RealType> dvec; |
| 1208 |
RealType rval; |
| 1209 |
AtomStamp* currAtomStamp = static_cast<AtomStamp*>(blockStack.top()); |
| 1210 |
|
| 1211 |
|
| 1212 |
#line 1213 "MDTreeParser.cpp" |
| 1213 |
|
| 1214 |
try { // for error handling |
| 1215 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1216 |
_t = ASTNULL; |
| 1217 |
switch ( _t->getType()) { |
| 1218 |
case ASSIGNEQUAL: |
| 1219 |
{ |
| 1220 |
assignment(_t); |
| 1221 |
_t = _retTree; |
| 1222 |
break; |
| 1223 |
} |
| 1224 |
case POSITION: |
| 1225 |
{ |
| 1226 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t43 = _t; |
| 1227 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp36_AST_in = _t; |
| 1228 |
match(_t,POSITION); |
| 1229 |
_t = _t->getFirstChild(); |
| 1230 |
dvec=doubleNumberTuple(_t); |
| 1231 |
_t = _retTree; |
| 1232 |
_t = __t43; |
| 1233 |
_t = _t->getNextSibling(); |
| 1234 |
#line 140 "MDTreeParser.g" |
| 1235 |
currAtomStamp->setPosition(dvec); |
| 1236 |
#line 1237 "MDTreeParser.cpp" |
| 1237 |
break; |
| 1238 |
} |
| 1239 |
case ORIENTATION: |
| 1240 |
{ |
| 1241 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t44 = _t; |
| 1242 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp37_AST_in = _t; |
| 1243 |
match(_t,ORIENTATION); |
| 1244 |
_t = _t->getFirstChild(); |
| 1245 |
dvec=doubleNumberTuple(_t); |
| 1246 |
_t = _retTree; |
| 1247 |
_t = __t44; |
| 1248 |
_t = _t->getNextSibling(); |
| 1249 |
#line 141 "MDTreeParser.g" |
| 1250 |
currAtomStamp->setOrientation(dvec); |
| 1251 |
#line 1252 "MDTreeParser.cpp" |
| 1252 |
break; |
| 1253 |
} |
| 1254 |
case CHARGE: |
| 1255 |
{ |
| 1256 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t45 = _t; |
| 1257 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp38_AST_in = _t; |
| 1258 |
match(_t,CHARGE); |
| 1259 |
_t = _t->getFirstChild(); |
| 1260 |
rval=doubleNumber(_t); |
| 1261 |
_t = _retTree; |
| 1262 |
_t = __t45; |
| 1263 |
_t = _t->getNextSibling(); |
| 1264 |
#line 142 "MDTreeParser.g" |
| 1265 |
currAtomStamp->overrideCharge(rval); |
| 1266 |
#line 1267 "MDTreeParser.cpp" |
| 1267 |
break; |
| 1268 |
} |
| 1269 |
default: |
| 1270 |
{ |
| 1271 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 1272 |
} |
| 1273 |
} |
| 1274 |
} |
| 1275 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1276 |
reportError(ex); |
| 1277 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1278 |
_t = _t->getNextSibling(); |
| 1279 |
} |
| 1280 |
_retTree = _t; |
| 1281 |
} |
| 1282 |
|
| 1283 |
RealType MDTreeParser::doubleNumber(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1284 |
#line 355 "MDTreeParser.g" |
| 1285 |
RealType dval; |
| 1286 |
#line 1287 "MDTreeParser.cpp" |
| 1287 |
ANTLR_USE_NAMESPACE(antlr)RefAST doubleNumber_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1288 |
ANTLR_USE_NAMESPACE(antlr)RefAST ic = ANTLR_USE_NAMESPACE(antlr)nullAST; |
| 1289 |
ANTLR_USE_NAMESPACE(antlr)RefAST fc = ANTLR_USE_NAMESPACE(antlr)nullAST; |
| 1290 |
|
| 1291 |
try { // for error handling |
| 1292 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1293 |
_t = ASTNULL; |
| 1294 |
switch ( _t->getType()) { |
| 1295 |
case NUM_INT: |
| 1296 |
case NUM_LONG: |
| 1297 |
{ |
| 1298 |
ic = (_t == ASTNULL) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1299 |
intConst(_t); |
| 1300 |
_t = _retTree; |
| 1301 |
#line 356 "MDTreeParser.g" |
| 1302 |
dval = lexi_cast<RealType>(ic->getText()); |
| 1303 |
#line 1304 "MDTreeParser.cpp" |
| 1304 |
break; |
| 1305 |
} |
| 1306 |
case NUM_FLOAT: |
| 1307 |
case NUM_DOUBLE: |
| 1308 |
{ |
| 1309 |
fc = (_t == ASTNULL) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1310 |
floatConst(_t); |
| 1311 |
_t = _retTree; |
| 1312 |
#line 357 "MDTreeParser.g" |
| 1313 |
dval = lexi_cast<RealType>(fc->getText()); |
| 1314 |
#line 1315 "MDTreeParser.cpp" |
| 1315 |
break; |
| 1316 |
} |
| 1317 |
default: |
| 1318 |
{ |
| 1319 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 1320 |
} |
| 1321 |
} |
| 1322 |
} |
| 1323 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1324 |
reportError(ex); |
| 1325 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1326 |
_t = _t->getNextSibling(); |
| 1327 |
} |
| 1328 |
_retTree = _t; |
| 1329 |
return dval; |
| 1330 |
} |
| 1331 |
|
| 1332 |
void MDTreeParser::bondstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1333 |
ANTLR_USE_NAMESPACE(antlr)RefAST bondstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1334 |
#line 157 "MDTreeParser.g" |
| 1335 |
|
| 1336 |
vector<int> ivec; |
| 1337 |
RealType rval; |
| 1338 |
vector<RealType> dvec; |
| 1339 |
BondStamp* currBondStamp = static_cast<BondStamp*>(blockStack.top()); |
| 1340 |
|
| 1341 |
#line 1342 "MDTreeParser.cpp" |
| 1342 |
|
| 1343 |
try { // for error handling |
| 1344 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1345 |
_t = ASTNULL; |
| 1346 |
switch ( _t->getType()) { |
| 1347 |
case ASSIGNEQUAL: |
| 1348 |
{ |
| 1349 |
assignment(_t); |
| 1350 |
_t = _retTree; |
| 1351 |
break; |
| 1352 |
} |
| 1353 |
case MEMBERS: |
| 1354 |
{ |
| 1355 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t51 = _t; |
| 1356 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp39_AST_in = _t; |
| 1357 |
match(_t,MEMBERS); |
| 1358 |
_t = _t->getFirstChild(); |
| 1359 |
ivec=inttuple(_t); |
| 1360 |
_t = _retTree; |
| 1361 |
_t = __t51; |
| 1362 |
_t = _t->getNextSibling(); |
| 1363 |
#line 165 "MDTreeParser.g" |
| 1364 |
currBondStamp->setMembers(ivec); |
| 1365 |
#line 1366 "MDTreeParser.cpp" |
| 1366 |
break; |
| 1367 |
} |
| 1368 |
case FIXED: |
| 1369 |
{ |
| 1370 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t52 = _t; |
| 1371 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp40_AST_in = _t; |
| 1372 |
match(_t,FIXED); |
| 1373 |
_t = _t->getFirstChild(); |
| 1374 |
rval=doubleNumber(_t); |
| 1375 |
_t = _retTree; |
| 1376 |
_t = __t52; |
| 1377 |
_t = _t->getNextSibling(); |
| 1378 |
#line 166 "MDTreeParser.g" |
| 1379 |
currBondStamp->overrideType("Fixed", rval); |
| 1380 |
#line 1381 "MDTreeParser.cpp" |
| 1381 |
break; |
| 1382 |
} |
| 1383 |
case HARMONIC: |
| 1384 |
{ |
| 1385 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t53 = _t; |
| 1386 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp41_AST_in = _t; |
| 1387 |
match(_t,HARMONIC); |
| 1388 |
_t = _t->getFirstChild(); |
| 1389 |
dvec=doubleNumberTuple(_t); |
| 1390 |
_t = _retTree; |
| 1391 |
_t = __t53; |
| 1392 |
_t = _t->getNextSibling(); |
| 1393 |
#line 167 "MDTreeParser.g" |
| 1394 |
currBondStamp->overrideType("Harmonic", dvec); |
| 1395 |
#line 1396 "MDTreeParser.cpp" |
| 1396 |
break; |
| 1397 |
} |
| 1398 |
case CUBIC: |
| 1399 |
{ |
| 1400 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t54 = _t; |
| 1401 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp42_AST_in = _t; |
| 1402 |
match(_t,CUBIC); |
| 1403 |
_t = _t->getFirstChild(); |
| 1404 |
dvec=doubleNumberTuple(_t); |
| 1405 |
_t = _retTree; |
| 1406 |
_t = __t54; |
| 1407 |
_t = _t->getNextSibling(); |
| 1408 |
#line 168 "MDTreeParser.g" |
| 1409 |
currBondStamp->overrideType("Cubic", dvec); |
| 1410 |
#line 1411 "MDTreeParser.cpp" |
| 1411 |
break; |
| 1412 |
} |
| 1413 |
case QUARTIC: |
| 1414 |
{ |
| 1415 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t55 = _t; |
| 1416 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp43_AST_in = _t; |
| 1417 |
match(_t,QUARTIC); |
| 1418 |
_t = _t->getFirstChild(); |
| 1419 |
dvec=doubleNumberTuple(_t); |
| 1420 |
_t = _retTree; |
| 1421 |
_t = __t55; |
| 1422 |
_t = _t->getNextSibling(); |
| 1423 |
#line 169 "MDTreeParser.g" |
| 1424 |
currBondStamp->overrideType("Quartic", dvec); |
| 1425 |
#line 1426 "MDTreeParser.cpp" |
| 1426 |
break; |
| 1427 |
} |
| 1428 |
case POLYNOMIAL: |
| 1429 |
{ |
| 1430 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t56 = _t; |
| 1431 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp44_AST_in = _t; |
| 1432 |
match(_t,POLYNOMIAL); |
| 1433 |
_t = _t->getFirstChild(); |
| 1434 |
dvec=doubleNumberTuple(_t); |
| 1435 |
_t = _retTree; |
| 1436 |
_t = __t56; |
| 1437 |
_t = _t->getNextSibling(); |
| 1438 |
#line 170 "MDTreeParser.g" |
| 1439 |
currBondStamp->overrideType("Polynomial", dvec); |
| 1440 |
#line 1441 "MDTreeParser.cpp" |
| 1441 |
break; |
| 1442 |
} |
| 1443 |
case MORSE: |
| 1444 |
{ |
| 1445 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t57 = _t; |
| 1446 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp45_AST_in = _t; |
| 1447 |
match(_t,MORSE); |
| 1448 |
_t = _t->getFirstChild(); |
| 1449 |
dvec=doubleNumberTuple(_t); |
| 1450 |
_t = _retTree; |
| 1451 |
_t = __t57; |
| 1452 |
_t = _t->getNextSibling(); |
| 1453 |
#line 171 "MDTreeParser.g" |
| 1454 |
currBondStamp->overrideType("Morse", dvec); |
| 1455 |
#line 1456 "MDTreeParser.cpp" |
| 1456 |
break; |
| 1457 |
} |
| 1458 |
default: |
| 1459 |
{ |
| 1460 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 1461 |
} |
| 1462 |
} |
| 1463 |
} |
| 1464 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1465 |
reportError(ex); |
| 1466 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1467 |
_t = _t->getNextSibling(); |
| 1468 |
} |
| 1469 |
_retTree = _t; |
| 1470 |
} |
| 1471 |
|
| 1472 |
vector<int> MDTreeParser::inttuple(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1473 |
#line 341 "MDTreeParser.g" |
| 1474 |
vector<int> ivec; |
| 1475 |
#line 1476 "MDTreeParser.cpp" |
| 1476 |
ANTLR_USE_NAMESPACE(antlr)RefAST inttuple_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1477 |
#line 341 "MDTreeParser.g" |
| 1478 |
|
| 1479 |
int ival; |
| 1480 |
|
| 1481 |
#line 1482 "MDTreeParser.cpp" |
| 1482 |
|
| 1483 |
try { // for error handling |
| 1484 |
{ // ( ... )+ |
| 1485 |
int _cnt125=0; |
| 1486 |
for (;;) { |
| 1487 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1488 |
_t = ASTNULL; |
| 1489 |
if ((_t->getType() == NUM_INT || _t->getType() == NUM_LONG)) { |
| 1490 |
ival=intConst(_t); |
| 1491 |
_t = _retTree; |
| 1492 |
#line 345 "MDTreeParser.g" |
| 1493 |
ivec.push_back(ival); |
| 1494 |
#line 1495 "MDTreeParser.cpp" |
| 1495 |
} |
| 1496 |
else { |
| 1497 |
if ( _cnt125>=1 ) { goto _loop125; } else {throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t);} |
| 1498 |
} |
| 1499 |
|
| 1500 |
_cnt125++; |
| 1501 |
} |
| 1502 |
_loop125:; |
| 1503 |
} // ( ... )+ |
| 1504 |
} |
| 1505 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1506 |
reportError(ex); |
| 1507 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1508 |
_t = _t->getNextSibling(); |
| 1509 |
} |
| 1510 |
_retTree = _t; |
| 1511 |
return ivec; |
| 1512 |
} |
| 1513 |
|
| 1514 |
void MDTreeParser::bendstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1515 |
ANTLR_USE_NAMESPACE(antlr)RefAST bendstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1516 |
#line 184 "MDTreeParser.g" |
| 1517 |
|
| 1518 |
vector<int> ivec; |
| 1519 |
vector<RealType> dvec; |
| 1520 |
BendStamp* currBendStamp = static_cast<BendStamp*>(blockStack.top()); |
| 1521 |
|
| 1522 |
#line 1523 "MDTreeParser.cpp" |
| 1523 |
|
| 1524 |
try { // for error handling |
| 1525 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1526 |
_t = ASTNULL; |
| 1527 |
switch ( _t->getType()) { |
| 1528 |
case ASSIGNEQUAL: |
| 1529 |
{ |
| 1530 |
assignment(_t); |
| 1531 |
_t = _retTree; |
| 1532 |
break; |
| 1533 |
} |
| 1534 |
case MEMBERS: |
| 1535 |
{ |
| 1536 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t63 = _t; |
| 1537 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp46_AST_in = _t; |
| 1538 |
match(_t,MEMBERS); |
| 1539 |
_t = _t->getFirstChild(); |
| 1540 |
ivec=inttuple(_t); |
| 1541 |
_t = _retTree; |
| 1542 |
_t = __t63; |
| 1543 |
_t = _t->getNextSibling(); |
| 1544 |
#line 191 "MDTreeParser.g" |
| 1545 |
currBendStamp->setMembers(ivec); |
| 1546 |
#line 1547 "MDTreeParser.cpp" |
| 1547 |
break; |
| 1548 |
} |
| 1549 |
case HARMONIC: |
| 1550 |
{ |
| 1551 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t64 = _t; |
| 1552 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp47_AST_in = _t; |
| 1553 |
match(_t,HARMONIC); |
| 1554 |
_t = _t->getFirstChild(); |
| 1555 |
dvec=doubleNumberTuple(_t); |
| 1556 |
_t = _retTree; |
| 1557 |
_t = __t64; |
| 1558 |
_t = _t->getNextSibling(); |
| 1559 |
#line 192 "MDTreeParser.g" |
| 1560 |
currBendStamp->overrideType("Harmonic", dvec); |
| 1561 |
#line 1562 "MDTreeParser.cpp" |
| 1562 |
break; |
| 1563 |
} |
| 1564 |
case GHOSTBEND: |
| 1565 |
{ |
| 1566 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t65 = _t; |
| 1567 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp48_AST_in = _t; |
| 1568 |
match(_t,GHOSTBEND); |
| 1569 |
_t = _t->getFirstChild(); |
| 1570 |
dvec=doubleNumberTuple(_t); |
| 1571 |
_t = _retTree; |
| 1572 |
_t = __t65; |
| 1573 |
_t = _t->getNextSibling(); |
| 1574 |
#line 193 "MDTreeParser.g" |
| 1575 |
currBendStamp->overrideType("GhostBend", dvec); |
| 1576 |
#line 1577 "MDTreeParser.cpp" |
| 1577 |
break; |
| 1578 |
} |
| 1579 |
case UREYBRADLEY: |
| 1580 |
{ |
| 1581 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t66 = _t; |
| 1582 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp49_AST_in = _t; |
| 1583 |
match(_t,UREYBRADLEY); |
| 1584 |
_t = _t->getFirstChild(); |
| 1585 |
dvec=doubleNumberTuple(_t); |
| 1586 |
_t = _retTree; |
| 1587 |
_t = __t66; |
| 1588 |
_t = _t->getNextSibling(); |
| 1589 |
#line 194 "MDTreeParser.g" |
| 1590 |
currBendStamp->overrideType("UreyBradley", dvec); |
| 1591 |
#line 1592 "MDTreeParser.cpp" |
| 1592 |
break; |
| 1593 |
} |
| 1594 |
case CUBIC: |
| 1595 |
{ |
| 1596 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t67 = _t; |
| 1597 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp50_AST_in = _t; |
| 1598 |
match(_t,CUBIC); |
| 1599 |
_t = _t->getFirstChild(); |
| 1600 |
dvec=doubleNumberTuple(_t); |
| 1601 |
_t = _retTree; |
| 1602 |
_t = __t67; |
| 1603 |
_t = _t->getNextSibling(); |
| 1604 |
#line 195 "MDTreeParser.g" |
| 1605 |
currBendStamp->overrideType("Cubic", dvec); |
| 1606 |
#line 1607 "MDTreeParser.cpp" |
| 1607 |
break; |
| 1608 |
} |
| 1609 |
case QUARTIC: |
| 1610 |
{ |
| 1611 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t68 = _t; |
| 1612 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp51_AST_in = _t; |
| 1613 |
match(_t,QUARTIC); |
| 1614 |
_t = _t->getFirstChild(); |
| 1615 |
dvec=doubleNumberTuple(_t); |
| 1616 |
_t = _retTree; |
| 1617 |
_t = __t68; |
| 1618 |
_t = _t->getNextSibling(); |
| 1619 |
#line 196 "MDTreeParser.g" |
| 1620 |
currBendStamp->overrideType("Quartic", dvec); |
| 1621 |
#line 1622 "MDTreeParser.cpp" |
| 1622 |
break; |
| 1623 |
} |
| 1624 |
case POLYNOMIAL: |
| 1625 |
{ |
| 1626 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t69 = _t; |
| 1627 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp52_AST_in = _t; |
| 1628 |
match(_t,POLYNOMIAL); |
| 1629 |
_t = _t->getFirstChild(); |
| 1630 |
dvec=doubleNumberTuple(_t); |
| 1631 |
_t = _retTree; |
| 1632 |
_t = __t69; |
| 1633 |
_t = _t->getNextSibling(); |
| 1634 |
#line 197 "MDTreeParser.g" |
| 1635 |
currBendStamp->overrideType("Polynomial", dvec); |
| 1636 |
#line 1637 "MDTreeParser.cpp" |
| 1637 |
break; |
| 1638 |
} |
| 1639 |
case COSINE: |
| 1640 |
{ |
| 1641 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t70 = _t; |
| 1642 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp53_AST_in = _t; |
| 1643 |
match(_t,COSINE); |
| 1644 |
_t = _t->getFirstChild(); |
| 1645 |
dvec=doubleNumberTuple(_t); |
| 1646 |
_t = _retTree; |
| 1647 |
_t = __t70; |
| 1648 |
_t = _t->getNextSibling(); |
| 1649 |
#line 198 "MDTreeParser.g" |
| 1650 |
currBendStamp->overrideType("Cosine", dvec); |
| 1651 |
#line 1652 "MDTreeParser.cpp" |
| 1652 |
break; |
| 1653 |
} |
| 1654 |
default: |
| 1655 |
{ |
| 1656 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 1657 |
} |
| 1658 |
} |
| 1659 |
} |
| 1660 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1661 |
reportError(ex); |
| 1662 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1663 |
_t = _t->getNextSibling(); |
| 1664 |
} |
| 1665 |
_retTree = _t; |
| 1666 |
} |
| 1667 |
|
| 1668 |
void MDTreeParser::torsionstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1669 |
ANTLR_USE_NAMESPACE(antlr)RefAST torsionstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1670 |
#line 211 "MDTreeParser.g" |
| 1671 |
|
| 1672 |
vector<int> ivec; |
| 1673 |
vector<RealType> dvec; |
| 1674 |
TorsionStamp* currTorsionStamp = static_cast<TorsionStamp*>(blockStack.top()); |
| 1675 |
|
| 1676 |
#line 1677 "MDTreeParser.cpp" |
| 1677 |
|
| 1678 |
try { // for error handling |
| 1679 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1680 |
_t = ASTNULL; |
| 1681 |
switch ( _t->getType()) { |
| 1682 |
case ASSIGNEQUAL: |
| 1683 |
{ |
| 1684 |
assignment(_t); |
| 1685 |
_t = _retTree; |
| 1686 |
break; |
| 1687 |
} |
| 1688 |
case MEMBERS: |
| 1689 |
{ |
| 1690 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t76 = _t; |
| 1691 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp54_AST_in = _t; |
| 1692 |
match(_t,MEMBERS); |
| 1693 |
_t = _t->getFirstChild(); |
| 1694 |
ivec=inttuple(_t); |
| 1695 |
_t = _retTree; |
| 1696 |
_t = __t76; |
| 1697 |
_t = _t->getNextSibling(); |
| 1698 |
#line 218 "MDTreeParser.g" |
| 1699 |
currTorsionStamp->setMembers(ivec); |
| 1700 |
#line 1701 "MDTreeParser.cpp" |
| 1701 |
break; |
| 1702 |
} |
| 1703 |
case GHOSTTORSION: |
| 1704 |
{ |
| 1705 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t77 = _t; |
| 1706 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp55_AST_in = _t; |
| 1707 |
match(_t,GHOSTTORSION); |
| 1708 |
_t = _t->getFirstChild(); |
| 1709 |
dvec=doubleNumberTuple(_t); |
| 1710 |
_t = _retTree; |
| 1711 |
_t = __t77; |
| 1712 |
_t = _t->getNextSibling(); |
| 1713 |
#line 219 "MDTreeParser.g" |
| 1714 |
currTorsionStamp->overrideType("GhostTorsion", dvec); |
| 1715 |
#line 1716 "MDTreeParser.cpp" |
| 1716 |
break; |
| 1717 |
} |
| 1718 |
case CUBIC: |
| 1719 |
{ |
| 1720 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t78 = _t; |
| 1721 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp56_AST_in = _t; |
| 1722 |
match(_t,CUBIC); |
| 1723 |
_t = _t->getFirstChild(); |
| 1724 |
dvec=doubleNumberTuple(_t); |
| 1725 |
_t = _retTree; |
| 1726 |
_t = __t78; |
| 1727 |
_t = _t->getNextSibling(); |
| 1728 |
#line 220 "MDTreeParser.g" |
| 1729 |
currTorsionStamp->overrideType("Cubic", dvec); |
| 1730 |
#line 1731 "MDTreeParser.cpp" |
| 1731 |
break; |
| 1732 |
} |
| 1733 |
case QUARTIC: |
| 1734 |
{ |
| 1735 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t79 = _t; |
| 1736 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp57_AST_in = _t; |
| 1737 |
match(_t,QUARTIC); |
| 1738 |
_t = _t->getFirstChild(); |
| 1739 |
dvec=doubleNumberTuple(_t); |
| 1740 |
_t = _retTree; |
| 1741 |
_t = __t79; |
| 1742 |
_t = _t->getNextSibling(); |
| 1743 |
#line 221 "MDTreeParser.g" |
| 1744 |
currTorsionStamp->overrideType("Quartic", dvec); |
| 1745 |
#line 1746 "MDTreeParser.cpp" |
| 1746 |
break; |
| 1747 |
} |
| 1748 |
case POLYNOMIAL: |
| 1749 |
{ |
| 1750 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t80 = _t; |
| 1751 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp58_AST_in = _t; |
| 1752 |
match(_t,POLYNOMIAL); |
| 1753 |
_t = _t->getFirstChild(); |
| 1754 |
dvec=doubleNumberTuple(_t); |
| 1755 |
_t = _retTree; |
| 1756 |
_t = __t80; |
| 1757 |
_t = _t->getNextSibling(); |
| 1758 |
#line 222 "MDTreeParser.g" |
| 1759 |
currTorsionStamp->overrideType("Polynomial", dvec); |
| 1760 |
#line 1761 "MDTreeParser.cpp" |
| 1761 |
break; |
| 1762 |
} |
| 1763 |
case CHARMM: |
| 1764 |
{ |
| 1765 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t81 = _t; |
| 1766 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp59_AST_in = _t; |
| 1767 |
match(_t,CHARMM); |
| 1768 |
_t = _t->getFirstChild(); |
| 1769 |
dvec=doubleNumberTuple(_t); |
| 1770 |
_t = _retTree; |
| 1771 |
_t = __t81; |
| 1772 |
_t = _t->getNextSibling(); |
| 1773 |
#line 223 "MDTreeParser.g" |
| 1774 |
currTorsionStamp->overrideType("Charmm", dvec); |
| 1775 |
#line 1776 "MDTreeParser.cpp" |
| 1776 |
break; |
| 1777 |
} |
| 1778 |
case OPLS: |
| 1779 |
{ |
| 1780 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t82 = _t; |
| 1781 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp60_AST_in = _t; |
| 1782 |
match(_t,OPLS); |
| 1783 |
_t = _t->getFirstChild(); |
| 1784 |
dvec=doubleNumberTuple(_t); |
| 1785 |
_t = _retTree; |
| 1786 |
_t = __t82; |
| 1787 |
_t = _t->getNextSibling(); |
| 1788 |
#line 224 "MDTreeParser.g" |
| 1789 |
currTorsionStamp->overrideType("Opls", dvec); |
| 1790 |
#line 1791 "MDTreeParser.cpp" |
| 1791 |
break; |
| 1792 |
} |
| 1793 |
case TRAPPE: |
| 1794 |
{ |
| 1795 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t83 = _t; |
| 1796 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp61_AST_in = _t; |
| 1797 |
match(_t,TRAPPE); |
| 1798 |
_t = _t->getFirstChild(); |
| 1799 |
dvec=doubleNumberTuple(_t); |
| 1800 |
_t = _retTree; |
| 1801 |
_t = __t83; |
| 1802 |
_t = _t->getNextSibling(); |
| 1803 |
#line 225 "MDTreeParser.g" |
| 1804 |
currTorsionStamp->overrideType("Trappe", dvec); |
| 1805 |
#line 1806 "MDTreeParser.cpp" |
| 1806 |
break; |
| 1807 |
} |
| 1808 |
case HARMONIC: |
| 1809 |
{ |
| 1810 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t84 = _t; |
| 1811 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp62_AST_in = _t; |
| 1812 |
match(_t,HARMONIC); |
| 1813 |
_t = _t->getFirstChild(); |
| 1814 |
dvec=doubleNumberTuple(_t); |
| 1815 |
_t = _retTree; |
| 1816 |
_t = __t84; |
| 1817 |
_t = _t->getNextSibling(); |
| 1818 |
#line 226 "MDTreeParser.g" |
| 1819 |
currTorsionStamp->overrideType("Harmonic", dvec); |
| 1820 |
#line 1821 "MDTreeParser.cpp" |
| 1821 |
break; |
| 1822 |
} |
| 1823 |
default: |
| 1824 |
{ |
| 1825 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 1826 |
} |
| 1827 |
} |
| 1828 |
} |
| 1829 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1830 |
reportError(ex); |
| 1831 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1832 |
_t = _t->getNextSibling(); |
| 1833 |
} |
| 1834 |
_retTree = _t; |
| 1835 |
} |
| 1836 |
|
| 1837 |
void MDTreeParser::inversionstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1838 |
ANTLR_USE_NAMESPACE(antlr)RefAST inversionstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1839 |
#line 240 "MDTreeParser.g" |
| 1840 |
|
| 1841 |
int icent; |
| 1842 |
vector<int> ivec; |
| 1843 |
vector<RealType> dvec; |
| 1844 |
InversionStamp* currInversionStamp = static_cast<InversionStamp*>(blockStack.top()); |
| 1845 |
|
| 1846 |
#line 1847 "MDTreeParser.cpp" |
| 1847 |
|
| 1848 |
try { // for error handling |
| 1849 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1850 |
_t = ASTNULL; |
| 1851 |
switch ( _t->getType()) { |
| 1852 |
case ASSIGNEQUAL: |
| 1853 |
{ |
| 1854 |
assignment(_t); |
| 1855 |
_t = _retTree; |
| 1856 |
break; |
| 1857 |
} |
| 1858 |
case CENTER: |
| 1859 |
{ |
| 1860 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t90 = _t; |
| 1861 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp63_AST_in = _t; |
| 1862 |
match(_t,CENTER); |
| 1863 |
_t = _t->getFirstChild(); |
| 1864 |
icent=intConst(_t); |
| 1865 |
_t = _retTree; |
| 1866 |
_t = __t90; |
| 1867 |
_t = _t->getNextSibling(); |
| 1868 |
#line 248 "MDTreeParser.g" |
| 1869 |
currInversionStamp->setCenter(icent); |
| 1870 |
#line 1871 "MDTreeParser.cpp" |
| 1871 |
break; |
| 1872 |
} |
| 1873 |
case SATELLITES: |
| 1874 |
{ |
| 1875 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t91 = _t; |
| 1876 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp64_AST_in = _t; |
| 1877 |
match(_t,SATELLITES); |
| 1878 |
_t = _t->getFirstChild(); |
| 1879 |
ivec=inttuple(_t); |
| 1880 |
_t = _retTree; |
| 1881 |
_t = __t91; |
| 1882 |
_t = _t->getNextSibling(); |
| 1883 |
#line 249 "MDTreeParser.g" |
| 1884 |
currInversionStamp->setSatellites(ivec); |
| 1885 |
#line 1886 "MDTreeParser.cpp" |
| 1886 |
break; |
| 1887 |
} |
| 1888 |
case AMBERIMPROPER: |
| 1889 |
{ |
| 1890 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t92 = _t; |
| 1891 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp65_AST_in = _t; |
| 1892 |
match(_t,AMBERIMPROPER); |
| 1893 |
_t = _t->getFirstChild(); |
| 1894 |
dvec=doubleNumberTuple(_t); |
| 1895 |
_t = _retTree; |
| 1896 |
_t = __t92; |
| 1897 |
_t = _t->getNextSibling(); |
| 1898 |
#line 250 "MDTreeParser.g" |
| 1899 |
currInversionStamp->overrideType("AmberImproper", dvec); |
| 1900 |
#line 1901 "MDTreeParser.cpp" |
| 1901 |
break; |
| 1902 |
} |
| 1903 |
case IMPROPERCOSINE: |
| 1904 |
{ |
| 1905 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t93 = _t; |
| 1906 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp66_AST_in = _t; |
| 1907 |
match(_t,IMPROPERCOSINE); |
| 1908 |
_t = _t->getFirstChild(); |
| 1909 |
dvec=doubleNumberTuple(_t); |
| 1910 |
_t = _retTree; |
| 1911 |
_t = __t93; |
| 1912 |
_t = _t->getNextSibling(); |
| 1913 |
#line 251 "MDTreeParser.g" |
| 1914 |
currInversionStamp->overrideType("ImproperCosine", dvec); |
| 1915 |
#line 1916 "MDTreeParser.cpp" |
| 1916 |
break; |
| 1917 |
} |
| 1918 |
case HARMONIC: |
| 1919 |
{ |
| 1920 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t94 = _t; |
| 1921 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp67_AST_in = _t; |
| 1922 |
match(_t,HARMONIC); |
| 1923 |
_t = _t->getFirstChild(); |
| 1924 |
dvec=doubleNumberTuple(_t); |
| 1925 |
_t = _retTree; |
| 1926 |
_t = __t94; |
| 1927 |
_t = _t->getNextSibling(); |
| 1928 |
#line 252 "MDTreeParser.g" |
| 1929 |
currInversionStamp->overrideType("Harmonic", dvec); |
| 1930 |
#line 1931 "MDTreeParser.cpp" |
| 1931 |
break; |
| 1932 |
} |
| 1933 |
case CENTRALATOMHEIGHT: |
| 1934 |
{ |
| 1935 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t95 = _t; |
| 1936 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp68_AST_in = _t; |
| 1937 |
match(_t,CENTRALATOMHEIGHT); |
| 1938 |
_t = _t->getFirstChild(); |
| 1939 |
dvec=doubleNumberTuple(_t); |
| 1940 |
_t = _retTree; |
| 1941 |
_t = __t95; |
| 1942 |
_t = _t->getNextSibling(); |
| 1943 |
#line 253 "MDTreeParser.g" |
| 1944 |
currInversionStamp->overrideType("CentralAtomHeight", dvec); |
| 1945 |
#line 1946 "MDTreeParser.cpp" |
| 1946 |
break; |
| 1947 |
} |
| 1948 |
case DREIDING: |
| 1949 |
{ |
| 1950 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t96 = _t; |
| 1951 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp69_AST_in = _t; |
| 1952 |
match(_t,DREIDING); |
| 1953 |
_t = _t->getFirstChild(); |
| 1954 |
dvec=doubleNumberTuple(_t); |
| 1955 |
_t = _retTree; |
| 1956 |
_t = __t96; |
| 1957 |
_t = _t->getNextSibling(); |
| 1958 |
#line 254 "MDTreeParser.g" |
| 1959 |
currInversionStamp->overrideType("Dreiding", dvec); |
| 1960 |
#line 1961 "MDTreeParser.cpp" |
| 1961 |
break; |
| 1962 |
} |
| 1963 |
default: |
| 1964 |
{ |
| 1965 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 1966 |
} |
| 1967 |
} |
| 1968 |
} |
| 1969 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 1970 |
reportError(ex); |
| 1971 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1972 |
_t = _t->getNextSibling(); |
| 1973 |
} |
| 1974 |
_retTree = _t; |
| 1975 |
} |
| 1976 |
|
| 1977 |
void MDTreeParser::rigidbodystatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 1978 |
ANTLR_USE_NAMESPACE(antlr)RefAST rigidbodystatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 1979 |
#line 272 "MDTreeParser.g" |
| 1980 |
|
| 1981 |
vector<int> ivec; |
| 1982 |
RigidBodyStamp* currRigidBodyStamp = static_cast<RigidBodyStamp*>(blockStack.top()); |
| 1983 |
|
| 1984 |
#line 1985 "MDTreeParser.cpp" |
| 1985 |
|
| 1986 |
try { // for error handling |
| 1987 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 1988 |
_t = ASTNULL; |
| 1989 |
switch ( _t->getType()) { |
| 1990 |
case ASSIGNEQUAL: |
| 1991 |
{ |
| 1992 |
assignment(_t); |
| 1993 |
_t = _retTree; |
| 1994 |
break; |
| 1995 |
} |
| 1996 |
case MEMBERS: |
| 1997 |
{ |
| 1998 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t102 = _t; |
| 1999 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp70_AST_in = _t; |
| 2000 |
match(_t,MEMBERS); |
| 2001 |
_t = _t->getFirstChild(); |
| 2002 |
ivec=inttuple(_t); |
| 2003 |
_t = _retTree; |
| 2004 |
_t = __t102; |
| 2005 |
_t = _t->getNextSibling(); |
| 2006 |
#line 278 "MDTreeParser.g" |
| 2007 |
currRigidBodyStamp->setMembers(ivec); |
| 2008 |
#line 2009 "MDTreeParser.cpp" |
| 2009 |
break; |
| 2010 |
} |
| 2011 |
default: |
| 2012 |
{ |
| 2013 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 2014 |
} |
| 2015 |
} |
| 2016 |
} |
| 2017 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 2018 |
reportError(ex); |
| 2019 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 2020 |
_t = _t->getNextSibling(); |
| 2021 |
} |
| 2022 |
_retTree = _t; |
| 2023 |
} |
| 2024 |
|
| 2025 |
void MDTreeParser::cutoffgroupstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 2026 |
ANTLR_USE_NAMESPACE(antlr)RefAST cutoffgroupstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 2027 |
#line 291 "MDTreeParser.g" |
| 2028 |
|
| 2029 |
vector<int> ivec; |
| 2030 |
CutoffGroupStamp* currCutoffGroupStamp = static_cast<CutoffGroupStamp*>(blockStack.top()); |
| 2031 |
|
| 2032 |
#line 2033 "MDTreeParser.cpp" |
| 2033 |
|
| 2034 |
try { // for error handling |
| 2035 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 2036 |
_t = ASTNULL; |
| 2037 |
switch ( _t->getType()) { |
| 2038 |
case ASSIGNEQUAL: |
| 2039 |
{ |
| 2040 |
assignment(_t); |
| 2041 |
_t = _retTree; |
| 2042 |
break; |
| 2043 |
} |
| 2044 |
case MEMBERS: |
| 2045 |
{ |
| 2046 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t108 = _t; |
| 2047 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp71_AST_in = _t; |
| 2048 |
match(_t,MEMBERS); |
| 2049 |
_t = _t->getFirstChild(); |
| 2050 |
ivec=inttuple(_t); |
| 2051 |
_t = _retTree; |
| 2052 |
_t = __t108; |
| 2053 |
_t = _t->getNextSibling(); |
| 2054 |
#line 297 "MDTreeParser.g" |
| 2055 |
currCutoffGroupStamp->setMembers(ivec); |
| 2056 |
#line 2057 "MDTreeParser.cpp" |
| 2057 |
break; |
| 2058 |
} |
| 2059 |
default: |
| 2060 |
{ |
| 2061 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 2062 |
} |
| 2063 |
} |
| 2064 |
} |
| 2065 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 2066 |
reportError(ex); |
| 2067 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 2068 |
_t = _t->getNextSibling(); |
| 2069 |
} |
| 2070 |
_retTree = _t; |
| 2071 |
} |
| 2072 |
|
| 2073 |
void MDTreeParser::fragmentstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 2074 |
ANTLR_USE_NAMESPACE(antlr)RefAST fragmentstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 2075 |
|
| 2076 |
try { // for error handling |
| 2077 |
assignment(_t); |
| 2078 |
_t = _retTree; |
| 2079 |
} |
| 2080 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 2081 |
reportError(ex); |
| 2082 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 2083 |
_t = _t->getNextSibling(); |
| 2084 |
} |
| 2085 |
_retTree = _t; |
| 2086 |
} |
| 2087 |
|
| 2088 |
void MDTreeParser::constraintstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
| 2089 |
ANTLR_USE_NAMESPACE(antlr)RefAST constraintstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
| 2090 |
#line 323 "MDTreeParser.g" |
| 2091 |
|
| 2092 |
vector<int> ivec; |
| 2093 |
ConstraintStamp* currConstraintStamp = static_cast<ConstraintStamp*>(blockStack.top()); |
| 2094 |
|
| 2095 |
#line 2096 "MDTreeParser.cpp" |
| 2096 |
|
| 2097 |
try { // for error handling |
| 2098 |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 2099 |
_t = ASTNULL; |
| 2100 |
switch ( _t->getType()) { |
| 2101 |
case ASSIGNEQUAL: |
| 2102 |
{ |
| 2103 |
assignment(_t); |
| 2104 |
_t = _retTree; |
| 2105 |
break; |
| 2106 |
} |
| 2107 |
case MEMBERS: |
| 2108 |
{ |
| 2109 |
ANTLR_USE_NAMESPACE(antlr)RefAST __t119 = _t; |
| 2110 |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp72_AST_in = _t; |
| 2111 |
match(_t,MEMBERS); |
| 2112 |
_t = _t->getFirstChild(); |
| 2113 |
ivec=inttuple(_t); |
| 2114 |
_t = _retTree; |
| 2115 |
_t = __t119; |
| 2116 |
_t = _t->getNextSibling(); |
| 2117 |
#line 329 "MDTreeParser.g" |
| 2118 |
currConstraintStamp->setMembers(ivec); |
| 2119 |
#line 2120 "MDTreeParser.cpp" |
| 2120 |
break; |
| 2121 |
} |
| 2122 |
default: |
| 2123 |
{ |
| 2124 |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
| 2125 |
} |
| 2126 |
} |
| 2127 |
} |
| 2128 |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
| 2129 |
reportError(ex); |
| 2130 |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
| 2131 |
_t = _t->getNextSibling(); |
| 2132 |
} |
| 2133 |
_retTree = _t; |
| 2134 |
} |
| 2135 |
|
| 2136 |
void MDTreeParser::initializeASTFactory( ANTLR_USE_NAMESPACE(antlr)ASTFactory& ) |
| 2137 |
{ |
| 2138 |
} |
| 2139 |
const char* MDTreeParser::tokenNames[] = { |
| 2140 |
"<0>", |
| 2141 |
"EOF", |
| 2142 |
"<2>", |
| 2143 |
"NULL_TREE_LOOKAHEAD", |
| 2144 |
"\"component\"", |
| 2145 |
"\"molecule\"", |
| 2146 |
"\"zconstraint\"", |
| 2147 |
"\"restraint\"", |
| 2148 |
"\"atom\"", |
| 2149 |
"\"bond\"", |
| 2150 |
"\"bend\"", |
| 2151 |
"\"torsion\"", |
| 2152 |
"\"inversion\"", |
| 2153 |
"\"rigidBody\"", |
| 2154 |
"\"cutoffGroup\"", |
| 2155 |
"\"constraint\"", |
| 2156 |
"\"distance\"", |
| 2157 |
"\"fragment\"", |
| 2158 |
"\"members\"", |
| 2159 |
"\"center\"", |
| 2160 |
"\"satellites\"", |
| 2161 |
"\"position\"", |
| 2162 |
"\"orientation\"", |
| 2163 |
"\"flucQ\"", |
| 2164 |
"\"RNEMD\"", |
| 2165 |
"\"minimizer\"", |
| 2166 |
"\"Fixed\"", |
| 2167 |
"\"Harmonic\"", |
| 2168 |
"\"Cubic\"", |
| 2169 |
"\"Quartic\"", |
| 2170 |
"\"Polynomial\"", |
| 2171 |
"\"Morse\"", |
| 2172 |
"\"GhostBend\"", |
| 2173 |
"\"UreyBradley\"", |
| 2174 |
"\"Cosine\"", |
| 2175 |
"\"GhostTorsion\"", |
| 2176 |
"\"Charmm\"", |
| 2177 |
"\"Opls\"", |
| 2178 |
"\"Trappe\"", |
| 2179 |
"\"AmberImproper\"", |
| 2180 |
"\"ImproperCosine\"", |
| 2181 |
"\"CentralAtomHeight\"", |
| 2182 |
"\"Dreiding\"", |
| 2183 |
"\"charge\"", |
| 2184 |
"ENDBLOCK", |
| 2185 |
"ID", |
| 2186 |
"ASSIGNEQUAL", |
| 2187 |
"SEMICOLON", |
| 2188 |
"StringLiteral", |
| 2189 |
"LCURLY", |
| 2190 |
"RCURLY", |
| 2191 |
"LBRACKET", |
| 2192 |
"RBRACKET", |
| 2193 |
"LPAREN", |
| 2194 |
"RPAREN", |
| 2195 |
"COMMA", |
| 2196 |
"NUM_INT", |
| 2197 |
"NUM_LONG", |
| 2198 |
"NUM_FLOAT", |
| 2199 |
"NUM_DOUBLE", |
| 2200 |
"DOT", |
| 2201 |
"COLON", |
| 2202 |
"QUESTIONMARK", |
| 2203 |
"Whitespace", |
| 2204 |
"Comment", |
| 2205 |
"CPPComment", |
| 2206 |
"a line directive", |
| 2207 |
"LineDirective", |
| 2208 |
"Space", |
| 2209 |
"CharLiteral", |
| 2210 |
"EndOfLine", |
| 2211 |
"Escape", |
| 2212 |
"Vocabulary", |
| 2213 |
"Digit", |
| 2214 |
"Decimal", |
| 2215 |
"HEX_DIGIT", |
| 2216 |
"EXPONENT", |
| 2217 |
"FLOAT_SUFFIX", |
| 2218 |
0 |
| 2219 |
}; |
| 2220 |
|
| 2221 |
const unsigned long MDTreeParser::_tokenSet_0_data_[] = { 58720496UL, 16384UL, 0UL, 0UL }; |
| 2222 |
// "component" "molecule" "zconstraint" "restraint" "flucQ" "RNEMD" "minimizer" |
| 2223 |
// ASSIGNEQUAL |
| 2224 |
const ANTLR_USE_NAMESPACE(antlr)BitSet MDTreeParser::_tokenSet_0(_tokenSet_0_data_,4); |
| 2225 |
const unsigned long MDTreeParser::_tokenSet_1_data_[] = { 196352UL, 16384UL, 0UL, 0UL }; |
| 2226 |
// "atom" "bond" "bend" "torsion" "inversion" "rigidBody" "cutoffGroup" |
| 2227 |
// "constraint" "fragment" ASSIGNEQUAL |
| 2228 |
const ANTLR_USE_NAMESPACE(antlr)BitSet MDTreeParser::_tokenSet_1(_tokenSet_1_data_,4); |
| 2229 |
const unsigned long MDTreeParser::_tokenSet_2_data_[] = { 6291456UL, 18432UL, 0UL, 0UL }; |
| 2230 |
// "position" "orientation" "charge" ASSIGNEQUAL |
| 2231 |
const ANTLR_USE_NAMESPACE(antlr)BitSet MDTreeParser::_tokenSet_2(_tokenSet_2_data_,4); |
| 2232 |
const unsigned long MDTreeParser::_tokenSet_3_data_[] = { 4228120576UL, 16384UL, 0UL, 0UL }; |
| 2233 |
// "members" "Fixed" "Harmonic" "Cubic" "Quartic" "Polynomial" "Morse" |
| 2234 |
// ASSIGNEQUAL |
| 2235 |
const ANTLR_USE_NAMESPACE(antlr)BitSet MDTreeParser::_tokenSet_3(_tokenSet_3_data_,4); |
| 2236 |
const unsigned long MDTreeParser::_tokenSet_4_data_[] = { 2013528064UL, 16391UL, 0UL, 0UL }; |
| 2237 |
// "members" "Harmonic" "Cubic" "Quartic" "Polynomial" "GhostBend" "UreyBradley" |
| 2238 |
// "Cosine" ASSIGNEQUAL |
| 2239 |
const ANTLR_USE_NAMESPACE(antlr)BitSet MDTreeParser::_tokenSet_4(_tokenSet_4_data_,4); |
| 2240 |
const unsigned long MDTreeParser::_tokenSet_5_data_[] = { 2013528064UL, 16504UL, 0UL, 0UL }; |
| 2241 |
// "members" "Harmonic" "Cubic" "Quartic" "Polynomial" "GhostTorsion" "Charmm" |
| 2242 |
// "Opls" "Trappe" ASSIGNEQUAL |
| 2243 |
const ANTLR_USE_NAMESPACE(antlr)BitSet MDTreeParser::_tokenSet_5(_tokenSet_5_data_,4); |
| 2244 |
const unsigned long MDTreeParser::_tokenSet_6_data_[] = { 135790592UL, 18304UL, 0UL, 0UL }; |
| 2245 |
// "center" "satellites" "Harmonic" "AmberImproper" "ImproperCosine" "CentralAtomHeight" |
| 2246 |
// "Dreiding" ASSIGNEQUAL |
| 2247 |
const ANTLR_USE_NAMESPACE(antlr)BitSet MDTreeParser::_tokenSet_6(_tokenSet_6_data_,4); |
| 2248 |
|
| 2249 |
|
