1 |
< |
/* $ANTLR 2.7.7 (20090623): "MDTreeParser.g" -> "MDTreeParser.cpp"$ */ |
1 |
> |
/* $ANTLR 2.7.7 (20110725): "MDTreeParser.g" -> "MDTreeParser.cpp"$ */ |
2 |
|
#include "MDTreeParser.hpp" |
3 |
|
#include <antlr/Token.hpp> |
4 |
|
#include <antlr/AST.hpp> |
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); |
145 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp2_AST_in = _t; |
146 |
|
match(_t,COMPONENT); |
147 |
|
_t = _t->getFirstChild(); |
148 |
< |
#line 63 "MDTreeParser.g" |
148 |
> |
#line 65 "MDTreeParser.g" |
149 |
|
Component* currComponet = new Component(); blockStack.push(currComponet); |
150 |
< |
#line 133 "MDTreeParser.cpp" |
150 |
> |
#line 151 "MDTreeParser.cpp" |
151 |
|
{ // ( ... )* |
152 |
|
for (;;) { |
153 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
168 |
|
_t = _t->getNextSibling(); |
169 |
|
_t = __t9; |
170 |
|
_t = _t->getNextSibling(); |
171 |
< |
#line 65 "MDTreeParser.g" |
171 |
> |
#line 67 "MDTreeParser.g" |
172 |
|
blockStack.top()->validate();blockStack.pop(); currConf->addComponent(currComponet); |
173 |
< |
#line 156 "MDTreeParser.cpp" |
173 |
> |
#line 174 "MDTreeParser.cpp" |
174 |
|
} |
175 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
176 |
|
reportError(ex); |
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 __t21 = _t; |
187 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t33 = _t; |
188 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp4_AST_in = _t; |
189 |
|
match(_t,MOLECULE); |
190 |
|
_t = _t->getFirstChild(); |
191 |
< |
#line 78 "MDTreeParser.g" |
191 |
> |
#line 96 "MDTreeParser.g" |
192 |
|
MoleculeStamp* currMoleculeStamp = new MoleculeStamp(); blockStack.push(currMoleculeStamp); |
193 |
< |
#line 176 "MDTreeParser.cpp" |
193 |
> |
#line 194 "MDTreeParser.cpp" |
194 |
|
{ // ( ... )* |
195 |
|
for (;;) { |
196 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
200 |
|
_t = _retTree; |
201 |
|
} |
202 |
|
else { |
203 |
< |
goto _loop23; |
203 |
> |
goto _loop35; |
204 |
|
} |
205 |
|
|
206 |
|
} |
207 |
< |
_loop23:; |
207 |
> |
_loop35:; |
208 |
|
} // ( ... )* |
209 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp5_AST_in = _t; |
210 |
|
match(_t,ENDBLOCK); |
211 |
|
_t = _t->getNextSibling(); |
212 |
< |
_t = __t21; |
212 |
> |
_t = __t33; |
213 |
|
_t = _t->getNextSibling(); |
214 |
< |
#line 80 "MDTreeParser.g" |
214 |
> |
#line 98 "MDTreeParser.g" |
215 |
|
blockStack.top()->validate(); blockStack.pop(); currConf->addMoleculeStamp(currMoleculeStamp); |
216 |
< |
#line 199 "MDTreeParser.cpp" |
216 |
> |
#line 217 "MDTreeParser.cpp" |
217 |
|
} |
218 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
219 |
|
reportError(ex); |
231 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp6_AST_in = _t; |
232 |
|
match(_t,ZCONSTRAINT); |
233 |
|
_t = _t->getFirstChild(); |
234 |
< |
#line 68 "MDTreeParser.g" |
234 |
> |
#line 70 "MDTreeParser.g" |
235 |
|
ZConsStamp* currZConsStamp = new ZConsStamp(); blockStack.push(currZConsStamp); |
236 |
< |
#line 219 "MDTreeParser.cpp" |
236 |
> |
#line 237 "MDTreeParser.cpp" |
237 |
|
{ // ( ... )* |
238 |
|
for (;;) { |
239 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
254 |
|
_t = _t->getNextSibling(); |
255 |
|
_t = __t13; |
256 |
|
_t = _t->getNextSibling(); |
257 |
< |
#line 70 "MDTreeParser.g" |
257 |
> |
#line 72 "MDTreeParser.g" |
258 |
|
blockStack.top()->validate();blockStack.pop(); currConf->addZConsStamp(currZConsStamp); |
259 |
< |
#line 242 "MDTreeParser.cpp" |
259 |
> |
#line 260 "MDTreeParser.cpp" |
260 |
|
} |
261 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
262 |
|
reportError(ex); |
274 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp8_AST_in = _t; |
275 |
|
match(_t,RESTRAINT); |
276 |
|
_t = _t->getFirstChild(); |
277 |
< |
#line 73 "MDTreeParser.g" |
277 |
> |
#line 75 "MDTreeParser.g" |
278 |
|
RestraintStamp* currRestraintStamp = new RestraintStamp(); blockStack.push(currRestraintStamp); |
279 |
< |
#line 262 "MDTreeParser.cpp" |
279 |
> |
#line 280 "MDTreeParser.cpp" |
280 |
|
{ // ( ... )* |
281 |
|
for (;;) { |
282 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
297 |
|
_t = _t->getNextSibling(); |
298 |
|
_t = __t17; |
299 |
|
_t = _t->getNextSibling(); |
300 |
< |
#line 75 "MDTreeParser.g" |
300 |
> |
#line 77 "MDTreeParser.g" |
301 |
|
blockStack.top()->validate();blockStack.pop(); currConf->addRestraintStamp(currRestraintStamp); |
302 |
< |
#line 285 "MDTreeParser.cpp" |
302 |
> |
#line 303 "MDTreeParser.cpp" |
303 |
|
} |
304 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
305 |
|
reportError(ex); |
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 __t21 = _t; |
317 |
+ |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp10_AST_in = _t; |
318 |
+ |
match(_t,FLUCQ); |
319 |
+ |
_t = _t->getFirstChild(); |
320 |
+ |
#line 80 "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 _loop23; |
333 |
+ |
} |
334 |
+ |
|
335 |
+ |
} |
336 |
+ |
_loop23:; |
337 |
+ |
} // ( ... )* |
338 |
+ |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp11_AST_in = _t; |
339 |
+ |
match(_t,ENDBLOCK); |
340 |
+ |
_t = _t->getNextSibling(); |
341 |
+ |
_t = __t21; |
342 |
+ |
_t = _t->getNextSibling(); |
343 |
+ |
#line 82 "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 __t25 = _t; |
360 |
+ |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp12_AST_in = _t; |
361 |
+ |
match(_t,RNEMD); |
362 |
+ |
_t = _t->getFirstChild(); |
363 |
+ |
#line 85 "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 _loop27; |
376 |
+ |
} |
377 |
+ |
|
378 |
+ |
} |
379 |
+ |
_loop27:; |
380 |
+ |
} // ( ... )* |
381 |
+ |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp13_AST_in = _t; |
382 |
+ |
match(_t,ENDBLOCK); |
383 |
+ |
_t = _t->getNextSibling(); |
384 |
+ |
_t = __t25; |
385 |
+ |
_t = _t->getNextSibling(); |
386 |
+ |
#line 87 "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 __t29 = _t; |
403 |
+ |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp14_AST_in = _t; |
404 |
+ |
match(_t,MINIMIZER); |
405 |
+ |
_t = _t->getFirstChild(); |
406 |
+ |
#line 90 "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 _loop31; |
419 |
+ |
} |
420 |
+ |
|
421 |
+ |
} |
422 |
+ |
_loop31:; |
423 |
+ |
} // ( ... )* |
424 |
+ |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp15_AST_in = _t; |
425 |
+ |
match(_t,ENDBLOCK); |
426 |
+ |
_t = _t->getNextSibling(); |
427 |
+ |
_t = __t29; |
428 |
+ |
_t = _t->getNextSibling(); |
429 |
+ |
#line 92 "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 48 "MDTreeParser.g" |
447 |
> |
#line 50 "MDTreeParser.g" |
448 |
|
|
449 |
|
int ival; |
450 |
|
RealType dval; |
451 |
|
|
452 |
< |
#line 306 "MDTreeParser.cpp" |
452 |
> |
#line 453 "MDTreeParser.cpp" |
453 |
|
|
454 |
|
try { // for error handling |
455 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
460 |
|
{ |
461 |
|
ival=intConst(_t); |
462 |
|
_t = _retTree; |
463 |
< |
#line 53 "MDTreeParser.g" |
463 |
> |
#line 55 "MDTreeParser.g" |
464 |
|
blockStack.top()->assign(id->getText(), ival); |
465 |
< |
#line 319 "MDTreeParser.cpp" |
465 |
> |
#line 466 "MDTreeParser.cpp" |
466 |
|
break; |
467 |
|
} |
468 |
|
case NUM_FLOAT: |
470 |
|
{ |
471 |
|
dval=floatConst(_t); |
472 |
|
_t = _retTree; |
473 |
< |
#line 54 "MDTreeParser.g" |
473 |
> |
#line 56 "MDTreeParser.g" |
474 |
|
blockStack.top()->assign(id->getText(), dval); |
475 |
< |
#line 329 "MDTreeParser.cpp" |
475 |
> |
#line 476 "MDTreeParser.cpp" |
476 |
|
break; |
477 |
|
} |
478 |
|
case ID: |
480 |
|
str1 = _t; |
481 |
|
match(_t,ID); |
482 |
|
_t = _t->getNextSibling(); |
483 |
< |
#line 55 "MDTreeParser.g" |
483 |
> |
#line 57 "MDTreeParser.g" |
484 |
|
blockStack.top()->assign(id->getText(), str1->getText()); |
485 |
< |
#line 339 "MDTreeParser.cpp" |
485 |
> |
#line 486 "MDTreeParser.cpp" |
486 |
|
break; |
487 |
|
} |
488 |
|
case StringLiteral: |
490 |
|
str2 = _t; |
491 |
|
match(_t,StringLiteral); |
492 |
|
_t = _t->getNextSibling(); |
493 |
< |
#line 56 "MDTreeParser.g" |
493 |
> |
#line 58 "MDTreeParser.g" |
494 |
|
std::string s = str2->getText(); |
495 |
|
s = s.substr(1, s.length()-2); |
496 |
|
blockStack.top()->assign(id->getText(),s); |
497 |
|
|
498 |
< |
#line 352 "MDTreeParser.cpp" |
498 |
> |
#line 499 "MDTreeParser.cpp" |
499 |
|
break; |
500 |
|
} |
501 |
|
default: |
513 |
|
} |
514 |
|
|
515 |
|
int MDTreeParser::intConst(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
516 |
< |
#line 268 "MDTreeParser.g" |
516 |
> |
#line 286 "MDTreeParser.g" |
517 |
|
int ival; |
518 |
< |
#line 372 "MDTreeParser.cpp" |
518 |
> |
#line 519 "MDTreeParser.cpp" |
519 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST intConst_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
520 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST i1 = ANTLR_USE_NAMESPACE(antlr)nullAST; |
521 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST i2 = ANTLR_USE_NAMESPACE(antlr)nullAST; |
529 |
|
i1 = _t; |
530 |
|
match(_t,NUM_INT); |
531 |
|
_t = _t->getNextSibling(); |
532 |
< |
#line 269 "MDTreeParser.g" |
532 |
> |
#line 287 "MDTreeParser.g" |
533 |
|
ival = lexi_cast<int>(i1->getText()); |
534 |
< |
#line 388 "MDTreeParser.cpp" |
534 |
> |
#line 535 "MDTreeParser.cpp" |
535 |
|
break; |
536 |
|
} |
537 |
|
case NUM_LONG: |
539 |
|
i2 = _t; |
540 |
|
match(_t,NUM_LONG); |
541 |
|
_t = _t->getNextSibling(); |
542 |
< |
#line 270 "MDTreeParser.g" |
542 |
> |
#line 288 "MDTreeParser.g" |
543 |
|
ival = lexi_cast<int>(i2->getText()); |
544 |
< |
#line 398 "MDTreeParser.cpp" |
544 |
> |
#line 545 "MDTreeParser.cpp" |
545 |
|
break; |
546 |
|
} |
547 |
|
default: |
560 |
|
} |
561 |
|
|
562 |
|
RealType MDTreeParser::floatConst(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
563 |
< |
#line 282 "MDTreeParser.g" |
563 |
> |
#line 300 "MDTreeParser.g" |
564 |
|
RealType dval; |
565 |
< |
#line 419 "MDTreeParser.cpp" |
565 |
> |
#line 566 "MDTreeParser.cpp" |
566 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST floatConst_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
567 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST d1 = ANTLR_USE_NAMESPACE(antlr)nullAST; |
568 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST d2 = ANTLR_USE_NAMESPACE(antlr)nullAST; |
576 |
|
d1 = _t; |
577 |
|
match(_t,NUM_FLOAT); |
578 |
|
_t = _t->getNextSibling(); |
579 |
< |
#line 283 "MDTreeParser.g" |
579 |
> |
#line 301 "MDTreeParser.g" |
580 |
|
dval = lexi_cast<RealType>(d1->getText()); |
581 |
< |
#line 435 "MDTreeParser.cpp" |
581 |
> |
#line 582 "MDTreeParser.cpp" |
582 |
|
break; |
583 |
|
} |
584 |
|
case NUM_DOUBLE: |
586 |
|
d2 = _t; |
587 |
|
match(_t,NUM_DOUBLE); |
588 |
|
_t = _t->getNextSibling(); |
589 |
< |
#line 284 "MDTreeParser.g" |
589 |
> |
#line 302 "MDTreeParser.g" |
590 |
|
dval = lexi_cast<RealType>(d2->getText()); |
591 |
< |
#line 445 "MDTreeParser.cpp" |
591 |
> |
#line 592 "MDTreeParser.cpp" |
592 |
|
break; |
593 |
|
} |
594 |
|
default: |
683 |
|
|
684 |
|
void MDTreeParser::atomblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
685 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST atomblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
686 |
< |
#line 94 "MDTreeParser.g" |
686 |
> |
#line 112 "MDTreeParser.g" |
687 |
|
|
688 |
|
int index; |
689 |
|
|
690 |
< |
#line 544 "MDTreeParser.cpp" |
690 |
> |
#line 691 "MDTreeParser.cpp" |
691 |
|
|
692 |
|
try { // for error handling |
693 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t26 = _t; |
694 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp10_AST_in = _t; |
693 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t38 = _t; |
694 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp16_AST_in = _t; |
695 |
|
match(_t,ATOM); |
696 |
|
_t = _t->getFirstChild(); |
697 |
|
index=intConst(_t); |
698 |
|
_t = _retTree; |
699 |
< |
#line 98 "MDTreeParser.g" |
699 |
> |
#line 116 "MDTreeParser.g" |
700 |
|
AtomStamp* currAtomStamp = new AtomStamp(index); blockStack.push(currAtomStamp); |
701 |
< |
#line 555 "MDTreeParser.cpp" |
701 |
> |
#line 702 "MDTreeParser.cpp" |
702 |
|
{ // ( ... )* |
703 |
|
for (;;) { |
704 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
708 |
|
_t = _retTree; |
709 |
|
} |
710 |
|
else { |
711 |
< |
goto _loop28; |
711 |
> |
goto _loop40; |
712 |
|
} |
713 |
|
|
714 |
|
} |
715 |
< |
_loop28:; |
715 |
> |
_loop40:; |
716 |
|
} // ( ... )* |
717 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp11_AST_in = _t; |
717 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp17_AST_in = _t; |
718 |
|
match(_t,ENDBLOCK); |
719 |
|
_t = _t->getNextSibling(); |
720 |
< |
_t = __t26; |
720 |
> |
_t = __t38; |
721 |
|
_t = _t->getNextSibling(); |
722 |
< |
#line 100 "MDTreeParser.g" |
722 |
> |
#line 118 "MDTreeParser.g" |
723 |
|
|
724 |
|
blockStack.top()->validate(); |
725 |
|
blockStack.pop(); |
726 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
727 |
|
currMoleculeStamp->addAtomStamp(currAtomStamp); |
728 |
|
|
729 |
< |
#line 583 "MDTreeParser.cpp" |
729 |
> |
#line 730 "MDTreeParser.cpp" |
730 |
|
} |
731 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
732 |
|
reportError(ex); |
740 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST bondblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
741 |
|
|
742 |
|
try { // for error handling |
743 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t33 = _t; |
744 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp12_AST_in = _t; |
743 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t45 = _t; |
744 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp18_AST_in = _t; |
745 |
|
match(_t,BOND); |
746 |
|
_t = _t->getFirstChild(); |
747 |
< |
#line 120 "MDTreeParser.g" |
747 |
> |
#line 138 "MDTreeParser.g" |
748 |
|
BondStamp* currBondStamp = new BondStamp(); blockStack.push(currBondStamp); |
749 |
< |
#line 603 "MDTreeParser.cpp" |
749 |
> |
#line 750 "MDTreeParser.cpp" |
750 |
|
{ // ( ... )* |
751 |
|
for (;;) { |
752 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
756 |
|
_t = _retTree; |
757 |
|
} |
758 |
|
else { |
759 |
< |
goto _loop35; |
759 |
> |
goto _loop47; |
760 |
|
} |
761 |
|
|
762 |
|
} |
763 |
< |
_loop35:; |
763 |
> |
_loop47:; |
764 |
|
} // ( ... )* |
765 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp13_AST_in = _t; |
765 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp19_AST_in = _t; |
766 |
|
match(_t,ENDBLOCK); |
767 |
|
_t = _t->getNextSibling(); |
768 |
< |
_t = __t33; |
768 |
> |
_t = __t45; |
769 |
|
_t = _t->getNextSibling(); |
770 |
< |
#line 122 "MDTreeParser.g" |
770 |
> |
#line 140 "MDTreeParser.g" |
771 |
|
|
772 |
|
blockStack.pop(); |
773 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
774 |
|
currMoleculeStamp->addBondStamp(currBondStamp); |
775 |
|
|
776 |
< |
#line 630 "MDTreeParser.cpp" |
776 |
> |
#line 777 "MDTreeParser.cpp" |
777 |
|
} |
778 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
779 |
|
reportError(ex); |
787 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST bendblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
788 |
|
|
789 |
|
try { // for error handling |
790 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t39 = _t; |
791 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp14_AST_in = _t; |
790 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t51 = _t; |
791 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp20_AST_in = _t; |
792 |
|
match(_t,BEND); |
793 |
|
_t = _t->getFirstChild(); |
794 |
< |
#line 138 "MDTreeParser.g" |
794 |
> |
#line 156 "MDTreeParser.g" |
795 |
|
BendStamp* currBendStamp = new BendStamp(); blockStack.push(currBendStamp); |
796 |
< |
#line 650 "MDTreeParser.cpp" |
796 |
> |
#line 797 "MDTreeParser.cpp" |
797 |
|
{ // ( ... )* |
798 |
|
for (;;) { |
799 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
803 |
|
_t = _retTree; |
804 |
|
} |
805 |
|
else { |
806 |
< |
goto _loop41; |
806 |
> |
goto _loop53; |
807 |
|
} |
808 |
|
|
809 |
|
} |
810 |
< |
_loop41:; |
810 |
> |
_loop53:; |
811 |
|
} // ( ... )* |
812 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp15_AST_in = _t; |
812 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp21_AST_in = _t; |
813 |
|
match(_t,ENDBLOCK); |
814 |
|
_t = _t->getNextSibling(); |
815 |
< |
_t = __t39; |
815 |
> |
_t = __t51; |
816 |
|
_t = _t->getNextSibling(); |
817 |
< |
#line 140 "MDTreeParser.g" |
817 |
> |
#line 158 "MDTreeParser.g" |
818 |
|
|
819 |
|
blockStack.top()->validate(); |
820 |
|
blockStack.pop(); |
821 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
822 |
|
currMoleculeStamp->addBendStamp(currBendStamp); |
823 |
|
|
824 |
< |
#line 678 "MDTreeParser.cpp" |
824 |
> |
#line 825 "MDTreeParser.cpp" |
825 |
|
} |
826 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
827 |
|
reportError(ex); |
835 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST torsionblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
836 |
|
|
837 |
|
try { // for error handling |
838 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t45 = _t; |
839 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp16_AST_in = _t; |
838 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t57 = _t; |
839 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp22_AST_in = _t; |
840 |
|
match(_t,TORSION); |
841 |
|
_t = _t->getFirstChild(); |
842 |
< |
#line 157 "MDTreeParser.g" |
842 |
> |
#line 175 "MDTreeParser.g" |
843 |
|
TorsionStamp* currTorsionStamp = new TorsionStamp(); blockStack.push(currTorsionStamp); |
844 |
< |
#line 698 "MDTreeParser.cpp" |
844 |
> |
#line 845 "MDTreeParser.cpp" |
845 |
|
{ // ( ... )* |
846 |
|
for (;;) { |
847 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
851 |
|
_t = _retTree; |
852 |
|
} |
853 |
|
else { |
854 |
< |
goto _loop47; |
854 |
> |
goto _loop59; |
855 |
|
} |
856 |
|
|
857 |
|
} |
858 |
< |
_loop47:; |
858 |
> |
_loop59:; |
859 |
|
} // ( ... )* |
860 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp17_AST_in = _t; |
860 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp23_AST_in = _t; |
861 |
|
match(_t,ENDBLOCK); |
862 |
|
_t = _t->getNextSibling(); |
863 |
< |
_t = __t45; |
863 |
> |
_t = __t57; |
864 |
|
_t = _t->getNextSibling(); |
865 |
< |
#line 159 "MDTreeParser.g" |
865 |
> |
#line 177 "MDTreeParser.g" |
866 |
|
|
867 |
|
blockStack.top()->validate(); |
868 |
|
blockStack.pop(); |
869 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
870 |
|
currMoleculeStamp->addTorsionStamp(currTorsionStamp); |
871 |
|
|
872 |
< |
#line 726 "MDTreeParser.cpp" |
872 |
> |
#line 873 "MDTreeParser.cpp" |
873 |
|
} |
874 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
875 |
|
reportError(ex); |
883 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST inversionblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
884 |
|
|
885 |
|
try { // for error handling |
886 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t51 = _t; |
887 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp18_AST_in = _t; |
886 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t63 = _t; |
887 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp24_AST_in = _t; |
888 |
|
match(_t,INVERSION); |
889 |
|
_t = _t->getFirstChild(); |
890 |
< |
#line 176 "MDTreeParser.g" |
890 |
> |
#line 194 "MDTreeParser.g" |
891 |
|
InversionStamp* currInversionStamp = new InversionStamp(); blockStack.push(currInversionStamp); |
892 |
< |
#line 746 "MDTreeParser.cpp" |
892 |
> |
#line 893 "MDTreeParser.cpp" |
893 |
|
{ // ( ... )* |
894 |
|
for (;;) { |
895 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
899 |
|
_t = _retTree; |
900 |
|
} |
901 |
|
else { |
902 |
< |
goto _loop53; |
902 |
> |
goto _loop65; |
903 |
|
} |
904 |
|
|
905 |
|
} |
906 |
< |
_loop53:; |
906 |
> |
_loop65:; |
907 |
|
} // ( ... )* |
908 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp19_AST_in = _t; |
908 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp25_AST_in = _t; |
909 |
|
match(_t,ENDBLOCK); |
910 |
|
_t = _t->getNextSibling(); |
911 |
< |
_t = __t51; |
911 |
> |
_t = __t63; |
912 |
|
_t = _t->getNextSibling(); |
913 |
< |
#line 178 "MDTreeParser.g" |
913 |
> |
#line 196 "MDTreeParser.g" |
914 |
|
|
915 |
|
blockStack.top()->validate(); |
916 |
|
blockStack.pop(); |
917 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
918 |
|
currMoleculeStamp->addInversionStamp(currInversionStamp); |
919 |
|
|
920 |
< |
#line 774 "MDTreeParser.cpp" |
920 |
> |
#line 921 "MDTreeParser.cpp" |
921 |
|
} |
922 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
923 |
|
reportError(ex); |
929 |
|
|
930 |
|
void MDTreeParser::rigidbodyblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
931 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST rigidbodyblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
932 |
< |
#line 195 "MDTreeParser.g" |
932 |
> |
#line 213 "MDTreeParser.g" |
933 |
|
|
934 |
|
int index; |
935 |
|
|
936 |
< |
#line 790 "MDTreeParser.cpp" |
936 |
> |
#line 937 "MDTreeParser.cpp" |
937 |
|
|
938 |
|
try { // for error handling |
939 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t57 = _t; |
940 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp20_AST_in = _t; |
939 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t69 = _t; |
940 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp26_AST_in = _t; |
941 |
|
match(_t,RIGIDBODY); |
942 |
|
_t = _t->getFirstChild(); |
943 |
|
index=intConst(_t); |
944 |
|
_t = _retTree; |
945 |
< |
#line 199 "MDTreeParser.g" |
945 |
> |
#line 217 "MDTreeParser.g" |
946 |
|
RigidBodyStamp* currRigidBodyStamp = new RigidBodyStamp(index); blockStack.push(currRigidBodyStamp); |
947 |
< |
#line 801 "MDTreeParser.cpp" |
947 |
> |
#line 948 "MDTreeParser.cpp" |
948 |
|
{ // ( ... )* |
949 |
|
for (;;) { |
950 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
954 |
|
_t = _retTree; |
955 |
|
} |
956 |
|
else { |
957 |
< |
goto _loop59; |
957 |
> |
goto _loop71; |
958 |
|
} |
959 |
|
|
960 |
|
} |
961 |
< |
_loop59:; |
961 |
> |
_loop71:; |
962 |
|
} // ( ... )* |
963 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp21_AST_in = _t; |
963 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp27_AST_in = _t; |
964 |
|
match(_t,ENDBLOCK); |
965 |
|
_t = _t->getNextSibling(); |
966 |
< |
_t = __t57; |
966 |
> |
_t = __t69; |
967 |
|
_t = _t->getNextSibling(); |
968 |
< |
#line 201 "MDTreeParser.g" |
968 |
> |
#line 219 "MDTreeParser.g" |
969 |
|
|
970 |
|
blockStack.top()->validate(); |
971 |
|
blockStack.pop(); |
972 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
973 |
|
currMoleculeStamp->addRigidBodyStamp(currRigidBodyStamp); |
974 |
|
|
975 |
< |
#line 829 "MDTreeParser.cpp" |
975 |
> |
#line 976 "MDTreeParser.cpp" |
976 |
|
} |
977 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
978 |
|
reportError(ex); |
986 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST cutoffgroupblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
987 |
|
|
988 |
|
try { // for error handling |
989 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t63 = _t; |
990 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp22_AST_in = _t; |
989 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t75 = _t; |
990 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp28_AST_in = _t; |
991 |
|
match(_t,CUTOFFGROUP); |
992 |
|
_t = _t->getFirstChild(); |
993 |
< |
#line 218 "MDTreeParser.g" |
993 |
> |
#line 236 "MDTreeParser.g" |
994 |
|
CutoffGroupStamp* currCutoffGroupStamp = new CutoffGroupStamp(); blockStack.push(currCutoffGroupStamp); |
995 |
< |
#line 849 "MDTreeParser.cpp" |
995 |
> |
#line 996 "MDTreeParser.cpp" |
996 |
|
{ // ( ... )* |
997 |
|
for (;;) { |
998 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1002 |
|
_t = _retTree; |
1003 |
|
} |
1004 |
|
else { |
1005 |
< |
goto _loop65; |
1005 |
> |
goto _loop77; |
1006 |
|
} |
1007 |
|
|
1008 |
|
} |
1009 |
< |
_loop65:; |
1009 |
> |
_loop77:; |
1010 |
|
} // ( ... )* |
1011 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp23_AST_in = _t; |
1011 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp29_AST_in = _t; |
1012 |
|
match(_t,ENDBLOCK); |
1013 |
|
_t = _t->getNextSibling(); |
1014 |
< |
_t = __t63; |
1014 |
> |
_t = __t75; |
1015 |
|
_t = _t->getNextSibling(); |
1016 |
< |
#line 220 "MDTreeParser.g" |
1016 |
> |
#line 238 "MDTreeParser.g" |
1017 |
|
|
1018 |
|
blockStack.top()->validate(); |
1019 |
|
blockStack.pop(); |
1020 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
1021 |
|
currMoleculeStamp->addCutoffGroupStamp(currCutoffGroupStamp); |
1022 |
|
|
1023 |
< |
#line 877 "MDTreeParser.cpp" |
1023 |
> |
#line 1024 "MDTreeParser.cpp" |
1024 |
|
} |
1025 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1026 |
|
reportError(ex); |
1032 |
|
|
1033 |
|
void MDTreeParser::fragmentblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1034 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST fragmentblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1035 |
< |
#line 237 "MDTreeParser.g" |
1035 |
> |
#line 255 "MDTreeParser.g" |
1036 |
|
int ival; |
1037 |
< |
#line 891 "MDTreeParser.cpp" |
1037 |
> |
#line 1038 "MDTreeParser.cpp" |
1038 |
|
|
1039 |
|
try { // for error handling |
1040 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t69 = _t; |
1041 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp24_AST_in = _t; |
1040 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t81 = _t; |
1041 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp30_AST_in = _t; |
1042 |
|
match(_t,FRAGMENT); |
1043 |
|
_t = _t->getFirstChild(); |
1044 |
|
ival=intConst(_t); |
1045 |
|
_t = _retTree; |
1046 |
< |
#line 238 "MDTreeParser.g" |
1046 |
> |
#line 256 "MDTreeParser.g" |
1047 |
|
FragmentStamp* currFragmentStamp = new FragmentStamp(ival); blockStack.push(currFragmentStamp); |
1048 |
< |
#line 902 "MDTreeParser.cpp" |
1048 |
> |
#line 1049 "MDTreeParser.cpp" |
1049 |
|
{ // ( ... )* |
1050 |
|
for (;;) { |
1051 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1055 |
|
_t = _retTree; |
1056 |
|
} |
1057 |
|
else { |
1058 |
< |
goto _loop71; |
1058 |
> |
goto _loop83; |
1059 |
|
} |
1060 |
|
|
1061 |
|
} |
1062 |
< |
_loop71:; |
1062 |
> |
_loop83:; |
1063 |
|
} // ( ... )* |
1064 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp25_AST_in = _t; |
1064 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp31_AST_in = _t; |
1065 |
|
match(_t,ENDBLOCK); |
1066 |
|
_t = _t->getNextSibling(); |
1067 |
< |
_t = __t69; |
1067 |
> |
_t = __t81; |
1068 |
|
_t = _t->getNextSibling(); |
1069 |
< |
#line 240 "MDTreeParser.g" |
1069 |
> |
#line 258 "MDTreeParser.g" |
1070 |
|
|
1071 |
|
blockStack.top()->validate(); |
1072 |
|
blockStack.pop(); |
1073 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
1074 |
|
currMoleculeStamp->addFragmentStamp(currFragmentStamp); |
1075 |
|
|
1076 |
< |
#line 930 "MDTreeParser.cpp" |
1076 |
> |
#line 1077 "MDTreeParser.cpp" |
1077 |
|
} |
1078 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1079 |
|
reportError(ex); |
1085 |
|
|
1086 |
|
void MDTreeParser::atomstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1087 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST atomstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1088 |
< |
#line 108 "MDTreeParser.g" |
1088 |
> |
#line 126 "MDTreeParser.g" |
1089 |
|
|
1090 |
|
vector<RealType> dvec; |
1091 |
|
AtomStamp* currAtomStamp = static_cast<AtomStamp*>(blockStack.top()); |
1092 |
|
|
1093 |
|
|
1094 |
< |
#line 948 "MDTreeParser.cpp" |
1094 |
> |
#line 1095 "MDTreeParser.cpp" |
1095 |
|
|
1096 |
|
try { // for error handling |
1097 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1105 |
|
} |
1106 |
|
case POSITION: |
1107 |
|
{ |
1108 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t30 = _t; |
1109 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp26_AST_in = _t; |
1108 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t42 = _t; |
1109 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp32_AST_in = _t; |
1110 |
|
match(_t,POSITION); |
1111 |
|
_t = _t->getFirstChild(); |
1112 |
|
dvec=doubleNumberTuple(_t); |
1113 |
|
_t = _retTree; |
1114 |
< |
_t = __t30; |
1114 |
> |
_t = __t42; |
1115 |
|
_t = _t->getNextSibling(); |
1116 |
< |
#line 115 "MDTreeParser.g" |
1116 |
> |
#line 133 "MDTreeParser.g" |
1117 |
|
currAtomStamp->setPosition(dvec); |
1118 |
< |
#line 972 "MDTreeParser.cpp" |
1118 |
> |
#line 1119 "MDTreeParser.cpp" |
1119 |
|
break; |
1120 |
|
} |
1121 |
|
case ORIENTATION: |
1122 |
|
{ |
1123 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t31 = _t; |
1124 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp27_AST_in = _t; |
1123 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t43 = _t; |
1124 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp33_AST_in = _t; |
1125 |
|
match(_t,ORIENTATION); |
1126 |
|
_t = _t->getFirstChild(); |
1127 |
|
dvec=doubleNumberTuple(_t); |
1128 |
|
_t = _retTree; |
1129 |
< |
_t = __t31; |
1129 |
> |
_t = __t43; |
1130 |
|
_t = _t->getNextSibling(); |
1131 |
< |
#line 116 "MDTreeParser.g" |
1131 |
> |
#line 134 "MDTreeParser.g" |
1132 |
|
currAtomStamp->setOrientation(dvec); |
1133 |
< |
#line 987 "MDTreeParser.cpp" |
1133 |
> |
#line 1134 "MDTreeParser.cpp" |
1134 |
|
break; |
1135 |
|
} |
1136 |
|
default: |
1148 |
|
} |
1149 |
|
|
1150 |
|
vector<RealType> MDTreeParser::doubleNumberTuple(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1151 |
< |
#line 253 "MDTreeParser.g" |
1151 |
> |
#line 271 "MDTreeParser.g" |
1152 |
|
vector<RealType> dvec; |
1153 |
< |
#line 1007 "MDTreeParser.cpp" |
1153 |
> |
#line 1154 "MDTreeParser.cpp" |
1154 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST doubleNumberTuple_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1155 |
< |
#line 253 "MDTreeParser.g" |
1155 |
> |
#line 271 "MDTreeParser.g" |
1156 |
|
|
1157 |
|
RealType dval; |
1158 |
|
|
1159 |
< |
#line 1013 "MDTreeParser.cpp" |
1159 |
> |
#line 1160 "MDTreeParser.cpp" |
1160 |
|
|
1161 |
|
try { // for error handling |
1162 |
|
{ // ( ... )+ |
1163 |
< |
int _cnt75=0; |
1163 |
> |
int _cnt87=0; |
1164 |
|
for (;;) { |
1165 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1166 |
|
_t = ASTNULL; |
1167 |
|
if (((_t->getType() >= NUM_INT && _t->getType() <= NUM_DOUBLE))) { |
1168 |
|
dval=doubleNumber(_t); |
1169 |
|
_t = _retTree; |
1170 |
< |
#line 257 "MDTreeParser.g" |
1170 |
> |
#line 275 "MDTreeParser.g" |
1171 |
|
dvec.push_back(dval); |
1172 |
< |
#line 1026 "MDTreeParser.cpp" |
1172 |
> |
#line 1173 "MDTreeParser.cpp" |
1173 |
|
} |
1174 |
|
else { |
1175 |
< |
if ( _cnt75>=1 ) { goto _loop75; } else {throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t);} |
1175 |
> |
if ( _cnt87>=1 ) { goto _loop87; } else {throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t);} |
1176 |
|
} |
1177 |
|
|
1178 |
< |
_cnt75++; |
1178 |
> |
_cnt87++; |
1179 |
|
} |
1180 |
< |
_loop75:; |
1180 |
> |
_loop87:; |
1181 |
|
} // ( ... )+ |
1182 |
|
} |
1183 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1191 |
|
|
1192 |
|
void MDTreeParser::bondstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1193 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST bondstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1194 |
< |
#line 129 "MDTreeParser.g" |
1194 |
> |
#line 147 "MDTreeParser.g" |
1195 |
|
|
1196 |
|
vector<int> ivec; |
1197 |
|
BondStamp* currBondStamp = static_cast<BondStamp*>(blockStack.top()); |
1198 |
|
|
1199 |
< |
#line 1053 "MDTreeParser.cpp" |
1199 |
> |
#line 1200 "MDTreeParser.cpp" |
1200 |
|
|
1201 |
|
try { // for error handling |
1202 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1210 |
|
} |
1211 |
|
case MEMBERS: |
1212 |
|
{ |
1213 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t37 = _t; |
1214 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp28_AST_in = _t; |
1213 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t49 = _t; |
1214 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp34_AST_in = _t; |
1215 |
|
match(_t,MEMBERS); |
1216 |
|
_t = _t->getFirstChild(); |
1217 |
|
ivec=inttuple(_t); |
1218 |
|
_t = _retTree; |
1219 |
< |
_t = __t37; |
1219 |
> |
_t = __t49; |
1220 |
|
_t = _t->getNextSibling(); |
1221 |
< |
#line 135 "MDTreeParser.g" |
1221 |
> |
#line 153 "MDTreeParser.g" |
1222 |
|
currBondStamp->setMembers(ivec); |
1223 |
< |
#line 1077 "MDTreeParser.cpp" |
1223 |
> |
#line 1224 "MDTreeParser.cpp" |
1224 |
|
break; |
1225 |
|
} |
1226 |
|
default: |
1238 |
|
} |
1239 |
|
|
1240 |
|
vector<int> MDTreeParser::inttuple(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1241 |
< |
#line 260 "MDTreeParser.g" |
1241 |
> |
#line 278 "MDTreeParser.g" |
1242 |
|
vector<int> ivec; |
1243 |
< |
#line 1097 "MDTreeParser.cpp" |
1243 |
> |
#line 1244 "MDTreeParser.cpp" |
1244 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST inttuple_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1245 |
< |
#line 260 "MDTreeParser.g" |
1245 |
> |
#line 278 "MDTreeParser.g" |
1246 |
|
|
1247 |
|
int ival; |
1248 |
|
|
1249 |
< |
#line 1103 "MDTreeParser.cpp" |
1249 |
> |
#line 1250 "MDTreeParser.cpp" |
1250 |
|
|
1251 |
|
try { // for error handling |
1252 |
|
{ // ( ... )+ |
1253 |
< |
int _cnt78=0; |
1253 |
> |
int _cnt90=0; |
1254 |
|
for (;;) { |
1255 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1256 |
|
_t = ASTNULL; |
1257 |
|
if ((_t->getType() == NUM_INT || _t->getType() == NUM_LONG)) { |
1258 |
|
ival=intConst(_t); |
1259 |
|
_t = _retTree; |
1260 |
< |
#line 264 "MDTreeParser.g" |
1260 |
> |
#line 282 "MDTreeParser.g" |
1261 |
|
ivec.push_back(ival); |
1262 |
< |
#line 1116 "MDTreeParser.cpp" |
1262 |
> |
#line 1263 "MDTreeParser.cpp" |
1263 |
|
} |
1264 |
|
else { |
1265 |
< |
if ( _cnt78>=1 ) { goto _loop78; } else {throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t);} |
1265 |
> |
if ( _cnt90>=1 ) { goto _loop90; } else {throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t);} |
1266 |
|
} |
1267 |
|
|
1268 |
< |
_cnt78++; |
1268 |
> |
_cnt90++; |
1269 |
|
} |
1270 |
< |
_loop78:; |
1270 |
> |
_loop90:; |
1271 |
|
} // ( ... )+ |
1272 |
|
} |
1273 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1281 |
|
|
1282 |
|
void MDTreeParser::bendstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1283 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST bendstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1284 |
< |
#line 148 "MDTreeParser.g" |
1284 |
> |
#line 166 "MDTreeParser.g" |
1285 |
|
|
1286 |
|
vector<int> ivec; |
1287 |
|
BendStamp* currBendStamp = static_cast<BendStamp*>(blockStack.top()); |
1288 |
|
|
1289 |
< |
#line 1143 "MDTreeParser.cpp" |
1289 |
> |
#line 1290 "MDTreeParser.cpp" |
1290 |
|
|
1291 |
|
try { // for error handling |
1292 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1300 |
|
} |
1301 |
|
case MEMBERS: |
1302 |
|
{ |
1303 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t43 = _t; |
1304 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp29_AST_in = _t; |
1303 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t55 = _t; |
1304 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp35_AST_in = _t; |
1305 |
|
match(_t,MEMBERS); |
1306 |
|
_t = _t->getFirstChild(); |
1307 |
|
ivec=inttuple(_t); |
1308 |
|
_t = _retTree; |
1309 |
< |
_t = __t43; |
1309 |
> |
_t = __t55; |
1310 |
|
_t = _t->getNextSibling(); |
1311 |
< |
#line 154 "MDTreeParser.g" |
1311 |
> |
#line 172 "MDTreeParser.g" |
1312 |
|
currBendStamp->setMembers(ivec); |
1313 |
< |
#line 1167 "MDTreeParser.cpp" |
1313 |
> |
#line 1314 "MDTreeParser.cpp" |
1314 |
|
break; |
1315 |
|
} |
1316 |
|
default: |
1329 |
|
|
1330 |
|
void MDTreeParser::torsionstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1331 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST torsionstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1332 |
< |
#line 167 "MDTreeParser.g" |
1332 |
> |
#line 185 "MDTreeParser.g" |
1333 |
|
|
1334 |
|
vector<int> ivec; |
1335 |
|
TorsionStamp* currTorsionStamp = static_cast<TorsionStamp*>(blockStack.top()); |
1336 |
|
|
1337 |
< |
#line 1191 "MDTreeParser.cpp" |
1337 |
> |
#line 1338 "MDTreeParser.cpp" |
1338 |
|
|
1339 |
|
try { // for error handling |
1340 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1348 |
|
} |
1349 |
|
case MEMBERS: |
1350 |
|
{ |
1351 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t49 = _t; |
1352 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp30_AST_in = _t; |
1351 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t61 = _t; |
1352 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp36_AST_in = _t; |
1353 |
|
match(_t,MEMBERS); |
1354 |
|
_t = _t->getFirstChild(); |
1355 |
|
ivec=inttuple(_t); |
1356 |
|
_t = _retTree; |
1357 |
< |
_t = __t49; |
1357 |
> |
_t = __t61; |
1358 |
|
_t = _t->getNextSibling(); |
1359 |
< |
#line 173 "MDTreeParser.g" |
1359 |
> |
#line 191 "MDTreeParser.g" |
1360 |
|
currTorsionStamp->setMembers(ivec); |
1361 |
< |
#line 1215 "MDTreeParser.cpp" |
1361 |
> |
#line 1362 "MDTreeParser.cpp" |
1362 |
|
break; |
1363 |
|
} |
1364 |
|
default: |
1377 |
|
|
1378 |
|
void MDTreeParser::inversionstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1379 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST inversionstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1380 |
< |
#line 186 "MDTreeParser.g" |
1380 |
> |
#line 204 "MDTreeParser.g" |
1381 |
|
|
1382 |
|
int icent; |
1383 |
|
InversionStamp* currInversionStamp = static_cast<InversionStamp*>(blockStack.top()); |
1384 |
|
|
1385 |
< |
#line 1239 "MDTreeParser.cpp" |
1385 |
> |
#line 1386 "MDTreeParser.cpp" |
1386 |
|
|
1387 |
|
try { // for error handling |
1388 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1396 |
|
} |
1397 |
|
case CENTER: |
1398 |
|
{ |
1399 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t55 = _t; |
1400 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp31_AST_in = _t; |
1399 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t67 = _t; |
1400 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp37_AST_in = _t; |
1401 |
|
match(_t,CENTER); |
1402 |
|
_t = _t->getFirstChild(); |
1403 |
|
icent=intConst(_t); |
1404 |
|
_t = _retTree; |
1405 |
< |
_t = __t55; |
1405 |
> |
_t = __t67; |
1406 |
|
_t = _t->getNextSibling(); |
1407 |
< |
#line 192 "MDTreeParser.g" |
1407 |
> |
#line 210 "MDTreeParser.g" |
1408 |
|
currInversionStamp->setCenter(icent); |
1409 |
< |
#line 1263 "MDTreeParser.cpp" |
1409 |
> |
#line 1410 "MDTreeParser.cpp" |
1410 |
|
break; |
1411 |
|
} |
1412 |
|
default: |
1425 |
|
|
1426 |
|
void MDTreeParser::rigidbodystatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1427 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST rigidbodystatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1428 |
< |
#line 209 "MDTreeParser.g" |
1428 |
> |
#line 227 "MDTreeParser.g" |
1429 |
|
|
1430 |
|
vector<int> ivec; |
1431 |
|
RigidBodyStamp* currRigidBodyStamp = static_cast<RigidBodyStamp*>(blockStack.top()); |
1432 |
|
|
1433 |
< |
#line 1287 "MDTreeParser.cpp" |
1433 |
> |
#line 1434 "MDTreeParser.cpp" |
1434 |
|
|
1435 |
|
try { // for error handling |
1436 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1444 |
|
} |
1445 |
|
case MEMBERS: |
1446 |
|
{ |
1447 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t61 = _t; |
1448 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp32_AST_in = _t; |
1447 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t73 = _t; |
1448 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp38_AST_in = _t; |
1449 |
|
match(_t,MEMBERS); |
1450 |
|
_t = _t->getFirstChild(); |
1451 |
|
ivec=inttuple(_t); |
1452 |
|
_t = _retTree; |
1453 |
< |
_t = __t61; |
1453 |
> |
_t = __t73; |
1454 |
|
_t = _t->getNextSibling(); |
1455 |
< |
#line 215 "MDTreeParser.g" |
1455 |
> |
#line 233 "MDTreeParser.g" |
1456 |
|
currRigidBodyStamp->setMembers(ivec); |
1457 |
< |
#line 1311 "MDTreeParser.cpp" |
1457 |
> |
#line 1458 "MDTreeParser.cpp" |
1458 |
|
break; |
1459 |
|
} |
1460 |
|
default: |
1473 |
|
|
1474 |
|
void MDTreeParser::cutoffgroupstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1475 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST cutoffgroupstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1476 |
< |
#line 228 "MDTreeParser.g" |
1476 |
> |
#line 246 "MDTreeParser.g" |
1477 |
|
|
1478 |
|
vector<int> ivec; |
1479 |
|
CutoffGroupStamp* currCutoffGroupStamp = static_cast<CutoffGroupStamp*>(blockStack.top()); |
1480 |
|
|
1481 |
< |
#line 1335 "MDTreeParser.cpp" |
1481 |
> |
#line 1482 "MDTreeParser.cpp" |
1482 |
|
|
1483 |
|
try { // for error handling |
1484 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1492 |
|
} |
1493 |
|
case MEMBERS: |
1494 |
|
{ |
1495 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST __t67 = _t; |
1496 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp33_AST_in = _t; |
1495 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST __t79 = _t; |
1496 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp39_AST_in = _t; |
1497 |
|
match(_t,MEMBERS); |
1498 |
|
_t = _t->getFirstChild(); |
1499 |
|
ivec=inttuple(_t); |
1500 |
|
_t = _retTree; |
1501 |
< |
_t = __t67; |
1501 |
> |
_t = __t79; |
1502 |
|
_t = _t->getNextSibling(); |
1503 |
< |
#line 234 "MDTreeParser.g" |
1503 |
> |
#line 252 "MDTreeParser.g" |
1504 |
|
currCutoffGroupStamp->setMembers(ivec); |
1505 |
< |
#line 1359 "MDTreeParser.cpp" |
1505 |
> |
#line 1506 "MDTreeParser.cpp" |
1506 |
|
break; |
1507 |
|
} |
1508 |
|
default: |
1535 |
|
} |
1536 |
|
|
1537 |
|
RealType MDTreeParser::doubleNumber(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1538 |
< |
#line 274 "MDTreeParser.g" |
1538 |
> |
#line 292 "MDTreeParser.g" |
1539 |
|
RealType dval; |
1540 |
< |
#line 1394 "MDTreeParser.cpp" |
1540 |
> |
#line 1541 "MDTreeParser.cpp" |
1541 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST doubleNumber_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1542 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST ic = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1543 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST fc = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1552 |
|
ic = (_t == ASTNULL) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1553 |
|
intConst(_t); |
1554 |
|
_t = _retTree; |
1555 |
< |
#line 276 "MDTreeParser.g" |
1555 |
> |
#line 294 "MDTreeParser.g" |
1556 |
|
dval = lexi_cast<RealType>(ic->getText()); |
1557 |
< |
#line 1411 "MDTreeParser.cpp" |
1557 |
> |
#line 1558 "MDTreeParser.cpp" |
1558 |
|
break; |
1559 |
|
} |
1560 |
|
case NUM_FLOAT: |
1563 |
|
fc = (_t == ASTNULL) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1564 |
|
floatConst(_t); |
1565 |
|
_t = _retTree; |
1566 |
< |
#line 277 "MDTreeParser.g" |
1566 |
> |
#line 295 "MDTreeParser.g" |
1567 |
|
dval = lexi_cast<RealType>(fc->getText()); |
1568 |
< |
#line 1422 "MDTreeParser.cpp" |
1568 |
> |
#line 1569 "MDTreeParser.cpp" |
1569 |
|
break; |
1570 |
|
} |
1571 |
|
default: |
1607 |
|
"\"center\"", |
1608 |
|
"\"position\"", |
1609 |
|
"\"orientation\"", |
1610 |
+ |
"\"flucQ\"", |
1611 |
+ |
"\"RNEMD\"", |
1612 |
+ |
"\"minimizer\"", |
1613 |
|
"ENDBLOCK", |
1614 |
|
"ID", |
1615 |
|
"ASSIGNEQUAL", |
1647 |
|
0 |
1648 |
|
}; |
1649 |
|
|
1650 |
< |
const unsigned long MDTreeParser::_tokenSet_0_data_[] = { 4194544UL, 0UL, 0UL, 0UL }; |
1651 |
< |
// "component" "molecule" "zconstraint" "restraint" ASSIGNEQUAL |
1650 |
> |
const unsigned long MDTreeParser::_tokenSet_0_data_[] = { 40894704UL, 0UL, 0UL, 0UL }; |
1651 |
> |
// "component" "molecule" "zconstraint" "restraint" "flucQ" "RNEMD" "minimizer" |
1652 |
> |
// ASSIGNEQUAL |
1653 |
|
const ANTLR_USE_NAMESPACE(antlr)BitSet MDTreeParser::_tokenSet_0(_tokenSet_0_data_,4); |
1654 |
< |
const unsigned long MDTreeParser::_tokenSet_1_data_[] = { 4259584UL, 0UL, 0UL, 0UL }; |
1654 |
> |
const unsigned long MDTreeParser::_tokenSet_1_data_[] = { 33619712UL, 0UL, 0UL, 0UL }; |
1655 |
|
// "atom" "bond" "bend" "torsion" "inversion" "rigidBody" "cutoffGroup" |
1656 |
|
// "fragment" ASSIGNEQUAL |
1657 |
|
const ANTLR_USE_NAMESPACE(antlr)BitSet MDTreeParser::_tokenSet_1(_tokenSet_1_data_,4); |