1 |
< |
/* $ANTLR 2.7.7 (20140107): "MDTreeParser.g" -> "MDTreeParser.cpp"$ */ |
1 |
> |
/* $ANTLR 2.7.7 (20131114): "MDTreeParser.g" -> "MDTreeParser.cpp"$ */ |
2 |
|
#include "MDTreeParser.hpp" |
3 |
|
#include <antlr/Token.hpp> |
4 |
|
#include <antlr/AST.hpp> |
145 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp2_AST_in = _t; |
146 |
|
match(_t,COMPONENT); |
147 |
|
_t = _t->getFirstChild(); |
148 |
< |
#line 72 "MDTreeParser.g" |
148 |
> |
#line 70 "MDTreeParser.g" |
149 |
|
Component* currComponet = new Component(); blockStack.push(currComponet); |
150 |
|
#line 151 "MDTreeParser.cpp" |
151 |
|
{ // ( ... )* |
168 |
|
_t = _t->getNextSibling(); |
169 |
|
_t = __t10; |
170 |
|
_t = _t->getNextSibling(); |
171 |
< |
#line 74 "MDTreeParser.g" |
171 |
> |
#line 72 "MDTreeParser.g" |
172 |
|
blockStack.top()->validate();blockStack.pop(); currConf->addComponent(currComponet); |
173 |
|
#line 174 "MDTreeParser.cpp" |
174 |
|
} |
188 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp4_AST_in = _t; |
189 |
|
match(_t,MOLECULE); |
190 |
|
_t = _t->getFirstChild(); |
191 |
< |
#line 103 "MDTreeParser.g" |
191 |
> |
#line 101 "MDTreeParser.g" |
192 |
|
MoleculeStamp* currMoleculeStamp = new MoleculeStamp(); blockStack.push(currMoleculeStamp); |
193 |
|
#line 194 "MDTreeParser.cpp" |
194 |
|
{ // ( ... )* |
211 |
|
_t = _t->getNextSibling(); |
212 |
|
_t = __t34; |
213 |
|
_t = _t->getNextSibling(); |
214 |
< |
#line 105 "MDTreeParser.g" |
214 |
> |
#line 103 "MDTreeParser.g" |
215 |
|
blockStack.top()->validate(); blockStack.pop(); currConf->addMoleculeStamp(currMoleculeStamp); |
216 |
|
#line 217 "MDTreeParser.cpp" |
217 |
|
} |
231 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp6_AST_in = _t; |
232 |
|
match(_t,ZCONSTRAINT); |
233 |
|
_t = _t->getFirstChild(); |
234 |
< |
#line 77 "MDTreeParser.g" |
234 |
> |
#line 75 "MDTreeParser.g" |
235 |
|
ZConsStamp* currZConsStamp = new ZConsStamp(); blockStack.push(currZConsStamp); |
236 |
|
#line 237 "MDTreeParser.cpp" |
237 |
|
{ // ( ... )* |
254 |
|
_t = _t->getNextSibling(); |
255 |
|
_t = __t14; |
256 |
|
_t = _t->getNextSibling(); |
257 |
< |
#line 79 "MDTreeParser.g" |
257 |
> |
#line 77 "MDTreeParser.g" |
258 |
|
blockStack.top()->validate();blockStack.pop(); currConf->addZConsStamp(currZConsStamp); |
259 |
|
#line 260 "MDTreeParser.cpp" |
260 |
|
} |
274 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp8_AST_in = _t; |
275 |
|
match(_t,RESTRAINT); |
276 |
|
_t = _t->getFirstChild(); |
277 |
< |
#line 82 "MDTreeParser.g" |
277 |
> |
#line 80 "MDTreeParser.g" |
278 |
|
RestraintStamp* currRestraintStamp = new RestraintStamp(); blockStack.push(currRestraintStamp); |
279 |
|
#line 280 "MDTreeParser.cpp" |
280 |
|
{ // ( ... )* |
297 |
|
_t = _t->getNextSibling(); |
298 |
|
_t = __t18; |
299 |
|
_t = _t->getNextSibling(); |
300 |
< |
#line 84 "MDTreeParser.g" |
300 |
> |
#line 82 "MDTreeParser.g" |
301 |
|
blockStack.top()->validate();blockStack.pop(); currConf->addRestraintStamp(currRestraintStamp); |
302 |
|
#line 303 "MDTreeParser.cpp" |
303 |
|
} |
317 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp10_AST_in = _t; |
318 |
|
match(_t,FLUCQ); |
319 |
|
_t = _t->getFirstChild(); |
320 |
< |
#line 87 "MDTreeParser.g" |
320 |
> |
#line 85 "MDTreeParser.g" |
321 |
|
FluctuatingChargeParameters* flucQpars = new FluctuatingChargeParameters(); blockStack.push(flucQpars); |
322 |
|
#line 323 "MDTreeParser.cpp" |
323 |
|
{ // ( ... )* |
340 |
|
_t = _t->getNextSibling(); |
341 |
|
_t = __t22; |
342 |
|
_t = _t->getNextSibling(); |
343 |
< |
#line 89 "MDTreeParser.g" |
343 |
> |
#line 87 "MDTreeParser.g" |
344 |
|
blockStack.top()->validate();blockStack.pop(); currConf->addFluctuatingChargeParameters(flucQpars); |
345 |
|
#line 346 "MDTreeParser.cpp" |
346 |
|
} |
360 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp12_AST_in = _t; |
361 |
|
match(_t,RNEMD); |
362 |
|
_t = _t->getFirstChild(); |
363 |
< |
#line 92 "MDTreeParser.g" |
363 |
> |
#line 90 "MDTreeParser.g" |
364 |
|
RNEMDParameters* rnemdPars = new RNEMDParameters(); blockStack.push(rnemdPars); |
365 |
|
#line 366 "MDTreeParser.cpp" |
366 |
|
{ // ( ... )* |
383 |
|
_t = _t->getNextSibling(); |
384 |
|
_t = __t26; |
385 |
|
_t = _t->getNextSibling(); |
386 |
< |
#line 94 "MDTreeParser.g" |
386 |
> |
#line 92 "MDTreeParser.g" |
387 |
|
blockStack.top()->validate();blockStack.pop(); currConf->addRNEMDParameters(rnemdPars); |
388 |
|
#line 389 "MDTreeParser.cpp" |
389 |
|
} |
403 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST tmp14_AST_in = _t; |
404 |
|
match(_t,MINIMIZER); |
405 |
|
_t = _t->getFirstChild(); |
406 |
< |
#line 97 "MDTreeParser.g" |
406 |
> |
#line 95 "MDTreeParser.g" |
407 |
|
MinimizerParameters* minimizerPars = new MinimizerParameters(); blockStack.push(minimizerPars); |
408 |
|
#line 409 "MDTreeParser.cpp" |
409 |
|
{ // ( ... )* |
426 |
|
_t = _t->getNextSibling(); |
427 |
|
_t = __t30; |
428 |
|
_t = _t->getNextSibling(); |
429 |
< |
#line 99 "MDTreeParser.g" |
429 |
> |
#line 97 "MDTreeParser.g" |
430 |
|
blockStack.top()->validate();blockStack.pop(); currConf->addMinimizerParameters(minimizerPars); |
431 |
|
#line 432 "MDTreeParser.cpp" |
432 |
|
} |
448 |
|
|
449 |
|
int ival; |
450 |
|
RealType dval, x, y, z; |
451 |
< |
Vector3d dvec; |
451 |
> |
std::vector<RealType> dvec; |
452 |
|
|
453 |
|
#line 454 "MDTreeParser.cpp" |
454 |
|
|
474 |
|
#line 57 "MDTreeParser.g" |
475 |
|
blockStack.top()->assign(id->getText(), dval); |
476 |
|
#line 477 "MDTreeParser.cpp" |
477 |
– |
break; |
478 |
– |
} |
479 |
– |
case LPAREN: |
480 |
– |
{ |
481 |
– |
ANTLR_USE_NAMESPACE(antlr)RefAST __t8 = _t; |
482 |
– |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp16_AST_in = _t; |
483 |
– |
match(_t,LPAREN); |
484 |
– |
_t = _t->getFirstChild(); |
485 |
– |
x=doubleNumber(_t); |
486 |
– |
_t = _retTree; |
487 |
– |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp17_AST_in = _t; |
488 |
– |
match(_t,COMMA); |
489 |
– |
_t = _t->getNextSibling(); |
490 |
– |
y=doubleNumber(_t); |
491 |
– |
_t = _retTree; |
492 |
– |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp18_AST_in = _t; |
493 |
– |
match(_t,COMMA); |
494 |
– |
_t = _t->getNextSibling(); |
495 |
– |
z=doubleNumber(_t); |
496 |
– |
_t = _retTree; |
497 |
– |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp19_AST_in = _t; |
498 |
– |
match(_t,RPAREN); |
499 |
– |
_t = _t->getNextSibling(); |
500 |
– |
_t = __t8; |
501 |
– |
_t = _t->getNextSibling(); |
502 |
– |
#line 59 "MDTreeParser.g" |
503 |
– |
dvec.x() = x; |
504 |
– |
dvec.y() = y; |
505 |
– |
dvec.z() = z; |
506 |
– |
blockStack.top()->assign(id->getText(), dvec); |
507 |
– |
|
508 |
– |
#line 509 "MDTreeParser.cpp" |
477 |
|
break; |
478 |
|
} |
479 |
|
case ID: |
481 |
|
str1 = _t; |
482 |
|
match(_t,ID); |
483 |
|
_t = _t->getNextSibling(); |
484 |
< |
#line 64 "MDTreeParser.g" |
484 |
> |
#line 58 "MDTreeParser.g" |
485 |
|
blockStack.top()->assign(id->getText(), str1->getText()); |
486 |
< |
#line 519 "MDTreeParser.cpp" |
486 |
> |
#line 487 "MDTreeParser.cpp" |
487 |
|
break; |
488 |
|
} |
489 |
|
case StringLiteral: |
491 |
|
str2 = _t; |
492 |
|
match(_t,StringLiteral); |
493 |
|
_t = _t->getNextSibling(); |
494 |
< |
#line 65 "MDTreeParser.g" |
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 532 "MDTreeParser.cpp" |
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); |
534 |
|
} |
535 |
|
|
536 |
|
int MDTreeParser::intConst(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
537 |
< |
#line 314 "MDTreeParser.g" |
537 |
> |
#line 312 "MDTreeParser.g" |
538 |
|
int ival; |
539 |
< |
#line 552 "MDTreeParser.cpp" |
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; |
550 |
|
i1 = _t; |
551 |
|
match(_t,NUM_INT); |
552 |
|
_t = _t->getNextSibling(); |
553 |
< |
#line 315 "MDTreeParser.g" |
553 |
> |
#line 313 "MDTreeParser.g" |
554 |
|
ival = lexi_cast<int>(i1->getText()); |
555 |
< |
#line 568 "MDTreeParser.cpp" |
555 |
> |
#line 556 "MDTreeParser.cpp" |
556 |
|
break; |
557 |
|
} |
558 |
|
case NUM_LONG: |
560 |
|
i2 = _t; |
561 |
|
match(_t,NUM_LONG); |
562 |
|
_t = _t->getNextSibling(); |
563 |
< |
#line 316 "MDTreeParser.g" |
563 |
> |
#line 314 "MDTreeParser.g" |
564 |
|
ival = lexi_cast<int>(i2->getText()); |
565 |
< |
#line 578 "MDTreeParser.cpp" |
565 |
> |
#line 566 "MDTreeParser.cpp" |
566 |
|
break; |
567 |
|
} |
568 |
|
default: |
581 |
|
} |
582 |
|
|
583 |
|
RealType MDTreeParser::floatConst(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
584 |
< |
#line 326 "MDTreeParser.g" |
584 |
> |
#line 324 "MDTreeParser.g" |
585 |
|
RealType dval; |
586 |
< |
#line 599 "MDTreeParser.cpp" |
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; |
597 |
|
d1 = _t; |
598 |
|
match(_t,NUM_FLOAT); |
599 |
|
_t = _t->getNextSibling(); |
600 |
< |
#line 327 "MDTreeParser.g" |
600 |
> |
#line 325 "MDTreeParser.g" |
601 |
|
dval = lexi_cast<RealType>(d1->getText()); |
602 |
< |
#line 615 "MDTreeParser.cpp" |
602 |
> |
#line 603 "MDTreeParser.cpp" |
603 |
|
break; |
604 |
|
} |
605 |
|
case NUM_DOUBLE: |
607 |
|
d2 = _t; |
608 |
|
match(_t,NUM_DOUBLE); |
609 |
|
_t = _t->getNextSibling(); |
610 |
< |
#line 328 "MDTreeParser.g" |
610 |
> |
#line 326 "MDTreeParser.g" |
611 |
|
dval = lexi_cast<RealType>(d2->getText()); |
612 |
< |
#line 625 "MDTreeParser.cpp" |
612 |
> |
#line 613 "MDTreeParser.cpp" |
613 |
|
break; |
614 |
|
} |
615 |
|
default: |
627 |
|
return dval; |
628 |
|
} |
629 |
|
|
630 |
< |
RealType MDTreeParser::doubleNumber(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
631 |
< |
#line 320 "MDTreeParser.g" |
630 |
> |
vector<RealType> MDTreeParser::doubleNumberTuple(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
631 |
> |
#line 296 "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 296 "MDTreeParser.g" |
636 |
> |
|
637 |
|
RealType dval; |
645 |
– |
#line 646 "MDTreeParser.cpp" |
646 |
– |
ANTLR_USE_NAMESPACE(antlr)RefAST doubleNumber_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
647 |
– |
ANTLR_USE_NAMESPACE(antlr)RefAST ic = ANTLR_USE_NAMESPACE(antlr)nullAST; |
648 |
– |
ANTLR_USE_NAMESPACE(antlr)RefAST fc = ANTLR_USE_NAMESPACE(antlr)nullAST; |
638 |
|
|
639 |
+ |
#line 640 "MDTreeParser.cpp" |
640 |
+ |
|
641 |
|
try { // for error handling |
642 |
< |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
643 |
< |
_t = ASTNULL; |
644 |
< |
switch ( _t->getType()) { |
645 |
< |
case NUM_INT: |
646 |
< |
case NUM_LONG: |
647 |
< |
{ |
648 |
< |
ic = (_t == ASTNULL) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
649 |
< |
intConst(_t); |
650 |
< |
_t = _retTree; |
651 |
< |
#line 321 "MDTreeParser.g" |
652 |
< |
dval = lexi_cast<RealType>(ic->getText()); |
653 |
< |
#line 663 "MDTreeParser.cpp" |
654 |
< |
break; |
642 |
> |
{ // ( ... )+ |
643 |
> |
int _cnt95=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 300 "MDTreeParser.g" |
651 |
> |
dvec.push_back(dval); |
652 |
> |
#line 653 "MDTreeParser.cpp" |
653 |
> |
} |
654 |
> |
else { |
655 |
> |
if ( _cnt95>=1 ) { goto _loop95; } else {throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t);} |
656 |
> |
} |
657 |
> |
|
658 |
> |
_cnt95++; |
659 |
|
} |
660 |
< |
case NUM_FLOAT: |
661 |
< |
case NUM_DOUBLE: |
667 |
< |
{ |
668 |
< |
fc = (_t == ASTNULL) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
669 |
< |
floatConst(_t); |
670 |
< |
_t = _retTree; |
671 |
< |
#line 322 "MDTreeParser.g" |
672 |
< |
dval = lexi_cast<RealType>(fc->getText()); |
673 |
< |
#line 674 "MDTreeParser.cpp" |
674 |
< |
break; |
675 |
< |
} |
676 |
< |
default: |
677 |
< |
{ |
678 |
< |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
679 |
< |
} |
680 |
< |
} |
660 |
> |
_loop95:; |
661 |
> |
} // ( ... )+ |
662 |
|
} |
663 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
664 |
|
reportError(ex); |
666 |
|
_t = _t->getNextSibling(); |
667 |
|
} |
668 |
|
_retTree = _t; |
669 |
< |
return dval; |
669 |
> |
return dvec; |
670 |
|
} |
671 |
|
|
672 |
|
void MDTreeParser::moleculestatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
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 120 "MDTreeParser.g" |
755 |
> |
#line 118 "MDTreeParser.g" |
756 |
|
|
757 |
|
int index; |
758 |
|
|
759 |
< |
#line 779 "MDTreeParser.cpp" |
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 tmp20_AST_in = _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 124 "MDTreeParser.g" |
768 |
> |
#line 122 "MDTreeParser.g" |
769 |
|
AtomStamp* currAtomStamp = new AtomStamp(index); blockStack.push(currAtomStamp); |
770 |
< |
#line 790 "MDTreeParser.cpp" |
770 |
> |
#line 771 "MDTreeParser.cpp" |
771 |
|
{ // ( ... )* |
772 |
|
for (;;) { |
773 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
783 |
|
} |
784 |
|
_loop41:; |
785 |
|
} // ( ... )* |
786 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp21_AST_in = _t; |
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 126 "MDTreeParser.g" |
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 818 "MDTreeParser.cpp" |
798 |
> |
#line 799 "MDTreeParser.cpp" |
799 |
|
} |
800 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
801 |
|
reportError(ex); |
810 |
|
|
811 |
|
try { // for error handling |
812 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t46 = _t; |
813 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp22_AST_in = _t; |
813 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp20_AST_in = _t; |
814 |
|
match(_t,BOND); |
815 |
|
_t = _t->getFirstChild(); |
816 |
< |
#line 146 "MDTreeParser.g" |
816 |
> |
#line 144 "MDTreeParser.g" |
817 |
|
BondStamp* currBondStamp = new BondStamp(); blockStack.push(currBondStamp); |
818 |
< |
#line 838 "MDTreeParser.cpp" |
818 |
> |
#line 819 "MDTreeParser.cpp" |
819 |
|
{ // ( ... )* |
820 |
|
for (;;) { |
821 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
831 |
|
} |
832 |
|
_loop48:; |
833 |
|
} // ( ... )* |
834 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp23_AST_in = _t; |
834 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp21_AST_in = _t; |
835 |
|
match(_t,ENDBLOCK); |
836 |
|
_t = _t->getNextSibling(); |
837 |
|
_t = __t46; |
838 |
|
_t = _t->getNextSibling(); |
839 |
< |
#line 148 "MDTreeParser.g" |
839 |
> |
#line 146 "MDTreeParser.g" |
840 |
|
|
841 |
|
blockStack.pop(); |
842 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
843 |
|
currMoleculeStamp->addBondStamp(currBondStamp); |
844 |
|
|
845 |
< |
#line 865 "MDTreeParser.cpp" |
845 |
> |
#line 846 "MDTreeParser.cpp" |
846 |
|
} |
847 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
848 |
|
reportError(ex); |
857 |
|
|
858 |
|
try { // for error handling |
859 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t52 = _t; |
860 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp24_AST_in = _t; |
860 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp22_AST_in = _t; |
861 |
|
match(_t,BEND); |
862 |
|
_t = _t->getFirstChild(); |
863 |
< |
#line 164 "MDTreeParser.g" |
863 |
> |
#line 162 "MDTreeParser.g" |
864 |
|
BendStamp* currBendStamp = new BendStamp(); blockStack.push(currBendStamp); |
865 |
< |
#line 885 "MDTreeParser.cpp" |
865 |
> |
#line 866 "MDTreeParser.cpp" |
866 |
|
{ // ( ... )* |
867 |
|
for (;;) { |
868 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
878 |
|
} |
879 |
|
_loop54:; |
880 |
|
} // ( ... )* |
881 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp25_AST_in = _t; |
881 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp23_AST_in = _t; |
882 |
|
match(_t,ENDBLOCK); |
883 |
|
_t = _t->getNextSibling(); |
884 |
|
_t = __t52; |
885 |
|
_t = _t->getNextSibling(); |
886 |
< |
#line 166 "MDTreeParser.g" |
886 |
> |
#line 164 "MDTreeParser.g" |
887 |
|
|
888 |
|
blockStack.top()->validate(); |
889 |
|
blockStack.pop(); |
890 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
891 |
|
currMoleculeStamp->addBendStamp(currBendStamp); |
892 |
|
|
893 |
< |
#line 913 "MDTreeParser.cpp" |
893 |
> |
#line 894 "MDTreeParser.cpp" |
894 |
|
} |
895 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
896 |
|
reportError(ex); |
905 |
|
|
906 |
|
try { // for error handling |
907 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t58 = _t; |
908 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp26_AST_in = _t; |
908 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp24_AST_in = _t; |
909 |
|
match(_t,TORSION); |
910 |
|
_t = _t->getFirstChild(); |
911 |
< |
#line 183 "MDTreeParser.g" |
911 |
> |
#line 181 "MDTreeParser.g" |
912 |
|
TorsionStamp* currTorsionStamp = new TorsionStamp(); blockStack.push(currTorsionStamp); |
913 |
< |
#line 933 "MDTreeParser.cpp" |
913 |
> |
#line 914 "MDTreeParser.cpp" |
914 |
|
{ // ( ... )* |
915 |
|
for (;;) { |
916 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
926 |
|
} |
927 |
|
_loop60:; |
928 |
|
} // ( ... )* |
929 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp27_AST_in = _t; |
929 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp25_AST_in = _t; |
930 |
|
match(_t,ENDBLOCK); |
931 |
|
_t = _t->getNextSibling(); |
932 |
|
_t = __t58; |
933 |
|
_t = _t->getNextSibling(); |
934 |
< |
#line 185 "MDTreeParser.g" |
934 |
> |
#line 183 "MDTreeParser.g" |
935 |
|
|
936 |
|
blockStack.top()->validate(); |
937 |
|
blockStack.pop(); |
938 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
939 |
|
currMoleculeStamp->addTorsionStamp(currTorsionStamp); |
940 |
|
|
941 |
< |
#line 961 "MDTreeParser.cpp" |
941 |
> |
#line 942 "MDTreeParser.cpp" |
942 |
|
} |
943 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
944 |
|
reportError(ex); |
953 |
|
|
954 |
|
try { // for error handling |
955 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t64 = _t; |
956 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp28_AST_in = _t; |
956 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp26_AST_in = _t; |
957 |
|
match(_t,INVERSION); |
958 |
|
_t = _t->getFirstChild(); |
959 |
< |
#line 202 "MDTreeParser.g" |
959 |
> |
#line 200 "MDTreeParser.g" |
960 |
|
InversionStamp* currInversionStamp = new InversionStamp(); blockStack.push(currInversionStamp); |
961 |
< |
#line 981 "MDTreeParser.cpp" |
961 |
> |
#line 962 "MDTreeParser.cpp" |
962 |
|
{ // ( ... )* |
963 |
|
for (;;) { |
964 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
974 |
|
} |
975 |
|
_loop66:; |
976 |
|
} // ( ... )* |
977 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp29_AST_in = _t; |
977 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp27_AST_in = _t; |
978 |
|
match(_t,ENDBLOCK); |
979 |
|
_t = _t->getNextSibling(); |
980 |
|
_t = __t64; |
981 |
|
_t = _t->getNextSibling(); |
982 |
< |
#line 204 "MDTreeParser.g" |
982 |
> |
#line 202 "MDTreeParser.g" |
983 |
|
|
984 |
|
blockStack.top()->validate(); |
985 |
|
blockStack.pop(); |
986 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
987 |
|
currMoleculeStamp->addInversionStamp(currInversionStamp); |
988 |
|
|
989 |
< |
#line 1009 "MDTreeParser.cpp" |
989 |
> |
#line 990 "MDTreeParser.cpp" |
990 |
|
} |
991 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
992 |
|
reportError(ex); |
998 |
|
|
999 |
|
void MDTreeParser::rigidbodyblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1000 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST rigidbodyblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1001 |
< |
#line 223 "MDTreeParser.g" |
1001 |
> |
#line 221 "MDTreeParser.g" |
1002 |
|
|
1003 |
|
int index; |
1004 |
|
|
1005 |
< |
#line 1025 "MDTreeParser.cpp" |
1005 |
> |
#line 1006 "MDTreeParser.cpp" |
1006 |
|
|
1007 |
|
try { // for error handling |
1008 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t71 = _t; |
1009 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp30_AST_in = _t; |
1009 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp28_AST_in = _t; |
1010 |
|
match(_t,RIGIDBODY); |
1011 |
|
_t = _t->getFirstChild(); |
1012 |
|
index=intConst(_t); |
1013 |
|
_t = _retTree; |
1014 |
< |
#line 227 "MDTreeParser.g" |
1014 |
> |
#line 225 "MDTreeParser.g" |
1015 |
|
RigidBodyStamp* currRigidBodyStamp = new RigidBodyStamp(index); blockStack.push(currRigidBodyStamp); |
1016 |
< |
#line 1036 "MDTreeParser.cpp" |
1016 |
> |
#line 1017 "MDTreeParser.cpp" |
1017 |
|
{ // ( ... )* |
1018 |
|
for (;;) { |
1019 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1029 |
|
} |
1030 |
|
_loop73:; |
1031 |
|
} // ( ... )* |
1032 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp31_AST_in = _t; |
1032 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp29_AST_in = _t; |
1033 |
|
match(_t,ENDBLOCK); |
1034 |
|
_t = _t->getNextSibling(); |
1035 |
|
_t = __t71; |
1036 |
|
_t = _t->getNextSibling(); |
1037 |
< |
#line 229 "MDTreeParser.g" |
1037 |
> |
#line 227 "MDTreeParser.g" |
1038 |
|
|
1039 |
|
blockStack.top()->validate(); |
1040 |
|
blockStack.pop(); |
1041 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
1042 |
|
currMoleculeStamp->addRigidBodyStamp(currRigidBodyStamp); |
1043 |
|
|
1044 |
< |
#line 1064 "MDTreeParser.cpp" |
1044 |
> |
#line 1045 "MDTreeParser.cpp" |
1045 |
|
} |
1046 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1047 |
|
reportError(ex); |
1056 |
|
|
1057 |
|
try { // for error handling |
1058 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t77 = _t; |
1059 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp32_AST_in = _t; |
1059 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp30_AST_in = _t; |
1060 |
|
match(_t,CUTOFFGROUP); |
1061 |
|
_t = _t->getFirstChild(); |
1062 |
< |
#line 246 "MDTreeParser.g" |
1062 |
> |
#line 244 "MDTreeParser.g" |
1063 |
|
CutoffGroupStamp* currCutoffGroupStamp = new CutoffGroupStamp(); blockStack.push(currCutoffGroupStamp); |
1064 |
< |
#line 1084 "MDTreeParser.cpp" |
1064 |
> |
#line 1065 "MDTreeParser.cpp" |
1065 |
|
{ // ( ... )* |
1066 |
|
for (;;) { |
1067 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1077 |
|
} |
1078 |
|
_loop79:; |
1079 |
|
} // ( ... )* |
1080 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp33_AST_in = _t; |
1080 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp31_AST_in = _t; |
1081 |
|
match(_t,ENDBLOCK); |
1082 |
|
_t = _t->getNextSibling(); |
1083 |
|
_t = __t77; |
1084 |
|
_t = _t->getNextSibling(); |
1085 |
< |
#line 248 "MDTreeParser.g" |
1085 |
> |
#line 246 "MDTreeParser.g" |
1086 |
|
|
1087 |
|
blockStack.top()->validate(); |
1088 |
|
blockStack.pop(); |
1089 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
1090 |
|
currMoleculeStamp->addCutoffGroupStamp(currCutoffGroupStamp); |
1091 |
|
|
1092 |
< |
#line 1112 "MDTreeParser.cpp" |
1092 |
> |
#line 1093 "MDTreeParser.cpp" |
1093 |
|
} |
1094 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1095 |
|
reportError(ex); |
1101 |
|
|
1102 |
|
void MDTreeParser::fragmentblock(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1103 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST fragmentblock_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1104 |
< |
#line 265 "MDTreeParser.g" |
1104 |
> |
#line 263 "MDTreeParser.g" |
1105 |
|
int ival; |
1106 |
< |
#line 1126 "MDTreeParser.cpp" |
1106 |
> |
#line 1107 "MDTreeParser.cpp" |
1107 |
|
|
1108 |
|
try { // for error handling |
1109 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t83 = _t; |
1110 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp34_AST_in = _t; |
1110 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp32_AST_in = _t; |
1111 |
|
match(_t,FRAGMENT); |
1112 |
|
_t = _t->getFirstChild(); |
1113 |
|
ival=intConst(_t); |
1114 |
|
_t = _retTree; |
1115 |
< |
#line 266 "MDTreeParser.g" |
1115 |
> |
#line 264 "MDTreeParser.g" |
1116 |
|
FragmentStamp* currFragmentStamp = new FragmentStamp(ival); blockStack.push(currFragmentStamp); |
1117 |
< |
#line 1137 "MDTreeParser.cpp" |
1117 |
> |
#line 1118 "MDTreeParser.cpp" |
1118 |
|
{ // ( ... )* |
1119 |
|
for (;;) { |
1120 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1130 |
|
} |
1131 |
|
_loop85:; |
1132 |
|
} // ( ... )* |
1133 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp35_AST_in = _t; |
1133 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp33_AST_in = _t; |
1134 |
|
match(_t,ENDBLOCK); |
1135 |
|
_t = _t->getNextSibling(); |
1136 |
|
_t = __t83; |
1137 |
|
_t = _t->getNextSibling(); |
1138 |
< |
#line 268 "MDTreeParser.g" |
1138 |
> |
#line 266 "MDTreeParser.g" |
1139 |
|
|
1140 |
|
blockStack.top()->validate(); |
1141 |
|
blockStack.pop(); |
1142 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
1143 |
|
currMoleculeStamp->addFragmentStamp(currFragmentStamp); |
1144 |
|
|
1145 |
< |
#line 1165 "MDTreeParser.cpp" |
1145 |
> |
#line 1146 "MDTreeParser.cpp" |
1146 |
|
} |
1147 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1148 |
|
reportError(ex); |
1157 |
|
|
1158 |
|
try { // for error handling |
1159 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t88 = _t; |
1160 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp36_AST_in = _t; |
1160 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp34_AST_in = _t; |
1161 |
|
match(_t,CONSTRAINT); |
1162 |
|
_t = _t->getFirstChild(); |
1163 |
< |
#line 279 "MDTreeParser.g" |
1163 |
> |
#line 277 "MDTreeParser.g" |
1164 |
|
ConstraintStamp* currConstraintStamp = new ConstraintStamp(); blockStack.push(currConstraintStamp); |
1165 |
< |
#line 1185 "MDTreeParser.cpp" |
1165 |
> |
#line 1166 "MDTreeParser.cpp" |
1166 |
|
{ // ( ... )* |
1167 |
|
for (;;) { |
1168 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1178 |
|
} |
1179 |
|
_loop90:; |
1180 |
|
} // ( ... )* |
1181 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp37_AST_in = _t; |
1181 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp35_AST_in = _t; |
1182 |
|
match(_t,ENDBLOCK); |
1183 |
|
_t = _t->getNextSibling(); |
1184 |
|
_t = __t88; |
1185 |
|
_t = _t->getNextSibling(); |
1186 |
< |
#line 281 "MDTreeParser.g" |
1186 |
> |
#line 279 "MDTreeParser.g" |
1187 |
|
|
1188 |
|
blockStack.pop(); |
1189 |
|
MoleculeStamp* currMoleculeStamp = static_cast<MoleculeStamp*>(blockStack.top()); |
1190 |
|
currMoleculeStamp->addConstraintStamp(currConstraintStamp); |
1191 |
|
|
1192 |
< |
#line 1212 "MDTreeParser.cpp" |
1192 |
> |
#line 1193 "MDTreeParser.cpp" |
1193 |
|
} |
1194 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1195 |
|
reportError(ex); |
1201 |
|
|
1202 |
|
void MDTreeParser::atomstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1203 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST atomstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1204 |
< |
#line 134 "MDTreeParser.g" |
1204 |
> |
#line 132 "MDTreeParser.g" |
1205 |
|
|
1206 |
|
vector<RealType> dvec; |
1207 |
|
AtomStamp* currAtomStamp = static_cast<AtomStamp*>(blockStack.top()); |
1208 |
|
|
1209 |
|
|
1210 |
< |
#line 1230 "MDTreeParser.cpp" |
1210 |
> |
#line 1211 "MDTreeParser.cpp" |
1211 |
|
|
1212 |
|
try { // for error handling |
1213 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1222 |
|
case POSITION: |
1223 |
|
{ |
1224 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t43 = _t; |
1225 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp38_AST_in = _t; |
1225 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp36_AST_in = _t; |
1226 |
|
match(_t,POSITION); |
1227 |
|
_t = _t->getFirstChild(); |
1228 |
|
dvec=doubleNumberTuple(_t); |
1229 |
|
_t = _retTree; |
1230 |
|
_t = __t43; |
1231 |
|
_t = _t->getNextSibling(); |
1232 |
< |
#line 141 "MDTreeParser.g" |
1232 |
> |
#line 139 "MDTreeParser.g" |
1233 |
|
currAtomStamp->setPosition(dvec); |
1234 |
< |
#line 1254 "MDTreeParser.cpp" |
1234 |
> |
#line 1235 "MDTreeParser.cpp" |
1235 |
|
break; |
1236 |
|
} |
1237 |
|
case ORIENTATION: |
1238 |
|
{ |
1239 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t44 = _t; |
1240 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp39_AST_in = _t; |
1240 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp37_AST_in = _t; |
1241 |
|
match(_t,ORIENTATION); |
1242 |
|
_t = _t->getFirstChild(); |
1243 |
|
dvec=doubleNumberTuple(_t); |
1244 |
|
_t = _retTree; |
1245 |
|
_t = __t44; |
1246 |
|
_t = _t->getNextSibling(); |
1247 |
< |
#line 142 "MDTreeParser.g" |
1247 |
> |
#line 140 "MDTreeParser.g" |
1248 |
|
currAtomStamp->setOrientation(dvec); |
1249 |
< |
#line 1269 "MDTreeParser.cpp" |
1249 |
> |
#line 1250 "MDTreeParser.cpp" |
1250 |
|
break; |
1251 |
|
} |
1252 |
|
default: |
1253 |
|
{ |
1254 |
|
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
1255 |
|
} |
1275 |
– |
} |
1276 |
– |
} |
1277 |
– |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1278 |
– |
reportError(ex); |
1279 |
– |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1280 |
– |
_t = _t->getNextSibling(); |
1281 |
– |
} |
1282 |
– |
_retTree = _t; |
1283 |
– |
} |
1284 |
– |
|
1285 |
– |
vector<RealType> MDTreeParser::doubleNumberTuple(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1286 |
– |
#line 298 "MDTreeParser.g" |
1287 |
– |
vector<RealType> dvec; |
1288 |
– |
#line 1289 "MDTreeParser.cpp" |
1289 |
– |
ANTLR_USE_NAMESPACE(antlr)RefAST doubleNumberTuple_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1290 |
– |
#line 298 "MDTreeParser.g" |
1291 |
– |
|
1292 |
– |
RealType dval; |
1293 |
– |
|
1294 |
– |
#line 1295 "MDTreeParser.cpp" |
1295 |
– |
|
1296 |
– |
try { // for error handling |
1297 |
– |
{ // ( ... )+ |
1298 |
– |
int _cnt95=0; |
1299 |
– |
for (;;) { |
1300 |
– |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1301 |
– |
_t = ASTNULL; |
1302 |
– |
if (((_t->getType() >= NUM_INT && _t->getType() <= NUM_DOUBLE))) { |
1303 |
– |
dval=doubleNumber(_t); |
1304 |
– |
_t = _retTree; |
1305 |
– |
#line 302 "MDTreeParser.g" |
1306 |
– |
dvec.push_back(dval); |
1307 |
– |
#line 1308 "MDTreeParser.cpp" |
1308 |
– |
} |
1309 |
– |
else { |
1310 |
– |
if ( _cnt95>=1 ) { goto _loop95; } else {throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t);} |
1311 |
– |
} |
1312 |
– |
|
1313 |
– |
_cnt95++; |
1256 |
|
} |
1315 |
– |
_loop95:; |
1316 |
– |
} // ( ... )+ |
1257 |
|
} |
1258 |
|
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1259 |
|
reportError(ex); |
1261 |
|
_t = _t->getNextSibling(); |
1262 |
|
} |
1263 |
|
_retTree = _t; |
1324 |
– |
return dvec; |
1264 |
|
} |
1265 |
|
|
1266 |
|
void MDTreeParser::bondstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1267 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST bondstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1268 |
< |
#line 155 "MDTreeParser.g" |
1268 |
> |
#line 153 "MDTreeParser.g" |
1269 |
|
|
1270 |
|
vector<int> ivec; |
1271 |
|
BondStamp* currBondStamp = static_cast<BondStamp*>(blockStack.top()); |
1272 |
|
|
1273 |
< |
#line 1335 "MDTreeParser.cpp" |
1273 |
> |
#line 1274 "MDTreeParser.cpp" |
1274 |
|
|
1275 |
|
try { // for error handling |
1276 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1285 |
|
case MEMBERS: |
1286 |
|
{ |
1287 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t50 = _t; |
1288 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp40_AST_in = _t; |
1288 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp38_AST_in = _t; |
1289 |
|
match(_t,MEMBERS); |
1290 |
|
_t = _t->getFirstChild(); |
1291 |
|
ivec=inttuple(_t); |
1292 |
|
_t = _retTree; |
1293 |
|
_t = __t50; |
1294 |
|
_t = _t->getNextSibling(); |
1295 |
< |
#line 161 "MDTreeParser.g" |
1295 |
> |
#line 159 "MDTreeParser.g" |
1296 |
|
currBondStamp->setMembers(ivec); |
1297 |
< |
#line 1359 "MDTreeParser.cpp" |
1297 |
> |
#line 1298 "MDTreeParser.cpp" |
1298 |
|
break; |
1299 |
|
} |
1300 |
|
default: |
1312 |
|
} |
1313 |
|
|
1314 |
|
vector<int> MDTreeParser::inttuple(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1315 |
< |
#line 306 "MDTreeParser.g" |
1315 |
> |
#line 304 "MDTreeParser.g" |
1316 |
|
vector<int> ivec; |
1317 |
< |
#line 1379 "MDTreeParser.cpp" |
1317 |
> |
#line 1318 "MDTreeParser.cpp" |
1318 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST inttuple_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1319 |
< |
#line 306 "MDTreeParser.g" |
1319 |
> |
#line 304 "MDTreeParser.g" |
1320 |
|
|
1321 |
|
int ival; |
1322 |
|
|
1323 |
< |
#line 1385 "MDTreeParser.cpp" |
1323 |
> |
#line 1324 "MDTreeParser.cpp" |
1324 |
|
|
1325 |
|
try { // for error handling |
1326 |
|
{ // ( ... )+ |
1331 |
|
if ((_t->getType() == NUM_INT || _t->getType() == NUM_LONG)) { |
1332 |
|
ival=intConst(_t); |
1333 |
|
_t = _retTree; |
1334 |
< |
#line 310 "MDTreeParser.g" |
1334 |
> |
#line 308 "MDTreeParser.g" |
1335 |
|
ivec.push_back(ival); |
1336 |
< |
#line 1398 "MDTreeParser.cpp" |
1336 |
> |
#line 1337 "MDTreeParser.cpp" |
1337 |
|
} |
1338 |
|
else { |
1339 |
|
if ( _cnt98>=1 ) { goto _loop98; } else {throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t);} |
1355 |
|
|
1356 |
|
void MDTreeParser::bendstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1357 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST bendstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1358 |
< |
#line 174 "MDTreeParser.g" |
1358 |
> |
#line 172 "MDTreeParser.g" |
1359 |
|
|
1360 |
|
vector<int> ivec; |
1361 |
|
BendStamp* currBendStamp = static_cast<BendStamp*>(blockStack.top()); |
1362 |
|
|
1363 |
< |
#line 1425 "MDTreeParser.cpp" |
1363 |
> |
#line 1364 "MDTreeParser.cpp" |
1364 |
|
|
1365 |
|
try { // for error handling |
1366 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1375 |
|
case MEMBERS: |
1376 |
|
{ |
1377 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t56 = _t; |
1378 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp41_AST_in = _t; |
1378 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp39_AST_in = _t; |
1379 |
|
match(_t,MEMBERS); |
1380 |
|
_t = _t->getFirstChild(); |
1381 |
|
ivec=inttuple(_t); |
1382 |
|
_t = _retTree; |
1383 |
|
_t = __t56; |
1384 |
|
_t = _t->getNextSibling(); |
1385 |
< |
#line 180 "MDTreeParser.g" |
1385 |
> |
#line 178 "MDTreeParser.g" |
1386 |
|
currBendStamp->setMembers(ivec); |
1387 |
< |
#line 1449 "MDTreeParser.cpp" |
1387 |
> |
#line 1388 "MDTreeParser.cpp" |
1388 |
|
break; |
1389 |
|
} |
1390 |
|
default: |
1403 |
|
|
1404 |
|
void MDTreeParser::torsionstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1405 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST torsionstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1406 |
< |
#line 193 "MDTreeParser.g" |
1406 |
> |
#line 191 "MDTreeParser.g" |
1407 |
|
|
1408 |
|
vector<int> ivec; |
1409 |
|
TorsionStamp* currTorsionStamp = static_cast<TorsionStamp*>(blockStack.top()); |
1410 |
|
|
1411 |
< |
#line 1473 "MDTreeParser.cpp" |
1411 |
> |
#line 1412 "MDTreeParser.cpp" |
1412 |
|
|
1413 |
|
try { // for error handling |
1414 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1423 |
|
case MEMBERS: |
1424 |
|
{ |
1425 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t62 = _t; |
1426 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp42_AST_in = _t; |
1426 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp40_AST_in = _t; |
1427 |
|
match(_t,MEMBERS); |
1428 |
|
_t = _t->getFirstChild(); |
1429 |
|
ivec=inttuple(_t); |
1430 |
|
_t = _retTree; |
1431 |
|
_t = __t62; |
1432 |
|
_t = _t->getNextSibling(); |
1433 |
< |
#line 199 "MDTreeParser.g" |
1433 |
> |
#line 197 "MDTreeParser.g" |
1434 |
|
currTorsionStamp->setMembers(ivec); |
1435 |
< |
#line 1497 "MDTreeParser.cpp" |
1435 |
> |
#line 1436 "MDTreeParser.cpp" |
1436 |
|
break; |
1437 |
|
} |
1438 |
|
default: |
1451 |
|
|
1452 |
|
void MDTreeParser::inversionstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1453 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST inversionstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1454 |
< |
#line 212 "MDTreeParser.g" |
1454 |
> |
#line 210 "MDTreeParser.g" |
1455 |
|
|
1456 |
|
int icent; |
1457 |
|
vector<int> ivec; |
1458 |
|
InversionStamp* currInversionStamp = static_cast<InversionStamp*>(blockStack.top()); |
1459 |
|
|
1460 |
< |
#line 1522 "MDTreeParser.cpp" |
1460 |
> |
#line 1461 "MDTreeParser.cpp" |
1461 |
|
|
1462 |
|
try { // for error handling |
1463 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1472 |
|
case CENTER: |
1473 |
|
{ |
1474 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t68 = _t; |
1475 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp43_AST_in = _t; |
1475 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp41_AST_in = _t; |
1476 |
|
match(_t,CENTER); |
1477 |
|
_t = _t->getFirstChild(); |
1478 |
|
icent=intConst(_t); |
1479 |
|
_t = _retTree; |
1480 |
|
_t = __t68; |
1481 |
|
_t = _t->getNextSibling(); |
1482 |
< |
#line 219 "MDTreeParser.g" |
1482 |
> |
#line 217 "MDTreeParser.g" |
1483 |
|
currInversionStamp->setCenter(icent); |
1484 |
< |
#line 1546 "MDTreeParser.cpp" |
1484 |
> |
#line 1485 "MDTreeParser.cpp" |
1485 |
|
break; |
1486 |
|
} |
1487 |
|
case SATELLITES: |
1488 |
|
{ |
1489 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t69 = _t; |
1490 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp44_AST_in = _t; |
1490 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp42_AST_in = _t; |
1491 |
|
match(_t,SATELLITES); |
1492 |
|
_t = _t->getFirstChild(); |
1493 |
|
ivec=inttuple(_t); |
1494 |
|
_t = _retTree; |
1495 |
|
_t = __t69; |
1496 |
|
_t = _t->getNextSibling(); |
1497 |
< |
#line 220 "MDTreeParser.g" |
1497 |
> |
#line 218 "MDTreeParser.g" |
1498 |
|
currInversionStamp->setSatellites(ivec); |
1499 |
< |
#line 1561 "MDTreeParser.cpp" |
1499 |
> |
#line 1500 "MDTreeParser.cpp" |
1500 |
|
break; |
1501 |
|
} |
1502 |
|
default: |
1515 |
|
|
1516 |
|
void MDTreeParser::rigidbodystatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1517 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST rigidbodystatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1518 |
< |
#line 237 "MDTreeParser.g" |
1518 |
> |
#line 235 "MDTreeParser.g" |
1519 |
|
|
1520 |
|
vector<int> ivec; |
1521 |
|
RigidBodyStamp* currRigidBodyStamp = static_cast<RigidBodyStamp*>(blockStack.top()); |
1522 |
|
|
1523 |
< |
#line 1585 "MDTreeParser.cpp" |
1523 |
> |
#line 1524 "MDTreeParser.cpp" |
1524 |
|
|
1525 |
|
try { // for error handling |
1526 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1535 |
|
case MEMBERS: |
1536 |
|
{ |
1537 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t75 = _t; |
1538 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp45_AST_in = _t; |
1538 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp43_AST_in = _t; |
1539 |
|
match(_t,MEMBERS); |
1540 |
|
_t = _t->getFirstChild(); |
1541 |
|
ivec=inttuple(_t); |
1542 |
|
_t = _retTree; |
1543 |
|
_t = __t75; |
1544 |
|
_t = _t->getNextSibling(); |
1545 |
< |
#line 243 "MDTreeParser.g" |
1545 |
> |
#line 241 "MDTreeParser.g" |
1546 |
|
currRigidBodyStamp->setMembers(ivec); |
1547 |
< |
#line 1609 "MDTreeParser.cpp" |
1547 |
> |
#line 1548 "MDTreeParser.cpp" |
1548 |
|
break; |
1549 |
|
} |
1550 |
|
default: |
1563 |
|
|
1564 |
|
void MDTreeParser::cutoffgroupstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1565 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST cutoffgroupstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1566 |
< |
#line 256 "MDTreeParser.g" |
1566 |
> |
#line 254 "MDTreeParser.g" |
1567 |
|
|
1568 |
|
vector<int> ivec; |
1569 |
|
CutoffGroupStamp* currCutoffGroupStamp = static_cast<CutoffGroupStamp*>(blockStack.top()); |
1570 |
|
|
1571 |
< |
#line 1633 "MDTreeParser.cpp" |
1571 |
> |
#line 1572 "MDTreeParser.cpp" |
1572 |
|
|
1573 |
|
try { // for error handling |
1574 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1583 |
|
case MEMBERS: |
1584 |
|
{ |
1585 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t81 = _t; |
1586 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp46_AST_in = _t; |
1586 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp44_AST_in = _t; |
1587 |
|
match(_t,MEMBERS); |
1588 |
|
_t = _t->getFirstChild(); |
1589 |
|
ivec=inttuple(_t); |
1590 |
|
_t = _retTree; |
1591 |
|
_t = __t81; |
1592 |
|
_t = _t->getNextSibling(); |
1593 |
< |
#line 262 "MDTreeParser.g" |
1593 |
> |
#line 260 "MDTreeParser.g" |
1594 |
|
currCutoffGroupStamp->setMembers(ivec); |
1595 |
< |
#line 1657 "MDTreeParser.cpp" |
1595 |
> |
#line 1596 "MDTreeParser.cpp" |
1596 |
|
break; |
1597 |
|
} |
1598 |
|
default: |
1626 |
|
|
1627 |
|
void MDTreeParser::constraintstatement(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1628 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST constraintstatement_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1629 |
< |
#line 288 "MDTreeParser.g" |
1629 |
> |
#line 286 "MDTreeParser.g" |
1630 |
|
|
1631 |
|
vector<int> ivec; |
1632 |
|
ConstraintStamp* currConstraintStamp = static_cast<ConstraintStamp*>(blockStack.top()); |
1633 |
|
|
1634 |
< |
#line 1696 "MDTreeParser.cpp" |
1634 |
> |
#line 1635 "MDTreeParser.cpp" |
1635 |
|
|
1636 |
|
try { // for error handling |
1637 |
|
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1646 |
|
case MEMBERS: |
1647 |
|
{ |
1648 |
|
ANTLR_USE_NAMESPACE(antlr)RefAST __t92 = _t; |
1649 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp47_AST_in = _t; |
1649 |
> |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp45_AST_in = _t; |
1650 |
|
match(_t,MEMBERS); |
1651 |
|
_t = _t->getFirstChild(); |
1652 |
|
ivec=inttuple(_t); |
1653 |
|
_t = _retTree; |
1654 |
|
_t = __t92; |
1655 |
|
_t = _t->getNextSibling(); |
1656 |
< |
#line 294 "MDTreeParser.g" |
1656 |
> |
#line 292 "MDTreeParser.g" |
1657 |
|
currConstraintStamp->setMembers(ivec); |
1658 |
< |
#line 1720 "MDTreeParser.cpp" |
1658 |
> |
#line 1659 "MDTreeParser.cpp" |
1659 |
|
break; |
1660 |
|
} |
1661 |
|
default: |
1672 |
|
_retTree = _t; |
1673 |
|
} |
1674 |
|
|
1675 |
+ |
RealType MDTreeParser::doubleNumber(ANTLR_USE_NAMESPACE(antlr)RefAST _t) { |
1676 |
+ |
#line 318 "MDTreeParser.g" |
1677 |
+ |
RealType dval; |
1678 |
+ |
#line 1679 "MDTreeParser.cpp" |
1679 |
+ |
ANTLR_USE_NAMESPACE(antlr)RefAST doubleNumber_AST_in = (_t == ANTLR_USE_NAMESPACE(antlr)RefAST(ASTNULL)) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1680 |
+ |
ANTLR_USE_NAMESPACE(antlr)RefAST ic = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1681 |
+ |
ANTLR_USE_NAMESPACE(antlr)RefAST fc = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1682 |
+ |
|
1683 |
+ |
try { // for error handling |
1684 |
+ |
if (_t == ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1685 |
+ |
_t = ASTNULL; |
1686 |
+ |
switch ( _t->getType()) { |
1687 |
+ |
case NUM_INT: |
1688 |
+ |
case NUM_LONG: |
1689 |
+ |
{ |
1690 |
+ |
ic = (_t == ASTNULL) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1691 |
+ |
intConst(_t); |
1692 |
+ |
_t = _retTree; |
1693 |
+ |
#line 319 "MDTreeParser.g" |
1694 |
+ |
dval = lexi_cast<RealType>(ic->getText()); |
1695 |
+ |
#line 1696 "MDTreeParser.cpp" |
1696 |
+ |
break; |
1697 |
+ |
} |
1698 |
+ |
case NUM_FLOAT: |
1699 |
+ |
case NUM_DOUBLE: |
1700 |
+ |
{ |
1701 |
+ |
fc = (_t == ASTNULL) ? ANTLR_USE_NAMESPACE(antlr)nullAST : _t; |
1702 |
+ |
floatConst(_t); |
1703 |
+ |
_t = _retTree; |
1704 |
+ |
#line 320 "MDTreeParser.g" |
1705 |
+ |
dval = lexi_cast<RealType>(fc->getText()); |
1706 |
+ |
#line 1707 "MDTreeParser.cpp" |
1707 |
+ |
break; |
1708 |
+ |
} |
1709 |
+ |
default: |
1710 |
+ |
{ |
1711 |
+ |
throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(_t); |
1712 |
+ |
} |
1713 |
+ |
} |
1714 |
+ |
} |
1715 |
+ |
catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) { |
1716 |
+ |
reportError(ex); |
1717 |
+ |
if ( _t != ANTLR_USE_NAMESPACE(antlr)nullAST ) |
1718 |
+ |
_t = _t->getNextSibling(); |
1719 |
+ |
} |
1720 |
+ |
_retTree = _t; |
1721 |
+ |
return dval; |
1722 |
+ |
} |
1723 |
+ |
|
1724 |
|
void MDTreeParser::initializeASTFactory( ANTLR_USE_NAMESPACE(antlr)ASTFactory& ) |
1725 |
|
{ |
1726 |
|
} |