[ViewVC] Diff of: OpenMD/trunk/src/mdParser/MDParser.cpp

Comparing trunk/src/mdParser/MDParser.cpp (file contents):
Revision 1979 by gezelter, Sat Apr 5 20:56:01 2014 UTC vs.
Revision 2046 by gezelter, Tue Dec 2 22:11:04 2014 UTC

#	Line 1 \| Line 1
1	<	/* $ANTLR 2.7.7 (20140107): "MDParser.g" -> "MDParser.cpp"$ */
1	>	/* $ANTLR 2.7.7 (20141024): "MDParser.g" -> "MDParser.cpp"$ */
2		#include "MDParser.hpp"
3		#include <antlr/NoViableAltException.hpp>
4		#include <antlr/SemanticException.hpp>
#	Line 188 \| Line 188 \| void MDParser::componentblock() {
188		tmp6_AST = astFactory->create(LT(1));
189		astFactory->addASTChild(currentAST, tmp6_AST);
190		match(RCURLY);
191	<	#line 77 "MDParser.g"
191	>	#line 95 "MDParser.g"
192		tmp6_AST->setType(ENDBLOCK);
193		#line 194 "MDParser.cpp"
194		componentblock_AST = currentAST.root;
#	Line 228 \| Line 228 \| void MDParser::moleculeblock() {
228		tmp9_AST = astFactory->create(LT(1));
229		astFactory->addASTChild(currentAST, tmp9_AST);
230		match(RCURLY);
231	<	#line 95 "MDParser.g"
231	>	#line 113 "MDParser.g"
232		tmp9_AST->setType(ENDBLOCK);
233		#line 234 "MDParser.cpp"
234		moleculeblock_AST = currentAST.root;
#	Line 268 \| Line 268 \| void MDParser::zconstraintblock() {
268		tmp12_AST = astFactory->create(LT(1));
269		astFactory->addASTChild(currentAST, tmp12_AST);
270		match(RCURLY);
271	<	#line 80 "MDParser.g"
271	>	#line 98 "MDParser.g"
272		tmp12_AST->setType(ENDBLOCK);
273		#line 274 "MDParser.cpp"
274		zconstraintblock_AST = currentAST.root;
#	Line 308 \| Line 308 \| void MDParser::restraintblock() {
308		tmp15_AST = astFactory->create(LT(1));
309		astFactory->addASTChild(currentAST, tmp15_AST);
310		match(RCURLY);
311	<	#line 83 "MDParser.g"
311	>	#line 101 "MDParser.g"
312		tmp15_AST->setType(ENDBLOCK);
313		#line 314 "MDParser.cpp"
314		restraintblock_AST = currentAST.root;
#	Line 348 \| Line 348 \| void MDParser::flucqblock() {
348		tmp18_AST = astFactory->create(LT(1));
349		astFactory->addASTChild(currentAST, tmp18_AST);
350		match(RCURLY);
351	<	#line 86 "MDParser.g"
351	>	#line 104 "MDParser.g"
352		tmp18_AST->setType(ENDBLOCK);
353		#line 354 "MDParser.cpp"
354		flucqblock_AST = currentAST.root;
#	Line 388 \| Line 388 \| void MDParser::rnemdblock() {
388		tmp21_AST = astFactory->create(LT(1));
389		astFactory->addASTChild(currentAST, tmp21_AST);
390		match(RCURLY);
391	<	#line 89 "MDParser.g"
391	>	#line 107 "MDParser.g"
392		tmp21_AST->setType(ENDBLOCK);
393		#line 394 "MDParser.cpp"
394		rnemdblock_AST = currentAST.root;
#	Line 428 \| Line 428 \| void MDParser::minimizerblock() {
428		tmp24_AST = astFactory->create(LT(1));
429		astFactory->addASTChild(currentAST, tmp24_AST);
430		match(RCURLY);
431	<	#line 92 "MDParser.g"
431	>	#line 110 "MDParser.g"
432		tmp24_AST->setType(ENDBLOCK);
433		#line 434 "MDParser.cpp"
434		minimizerblock_AST = currentAST.root;
#	Line 587 \| Line 587 \| void MDParser::vectorConst() {
587		tmp31_AST = astFactory->create(LT(1));
588		astFactory->makeASTRoot(currentAST, tmp31_AST);
589		match(LPAREN);
590	<	doubleNumber();
590	>	doubleNumberTuple();
591		astFactory->addASTChild( currentAST, returnAST );
592		ANTLR_USE_NAMESPACE(antlr)RefAST tmp32_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
593		tmp32_AST = astFactory->create(LT(1));
594		astFactory->addASTChild(currentAST, tmp32_AST);
595	–	match(COMMA);
596	–	doubleNumber();
597	–	astFactory->addASTChild( currentAST, returnAST );
598	–	ANTLR_USE_NAMESPACE(antlr)RefAST tmp33_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
599	–	tmp33_AST = astFactory->create(LT(1));
600	–	astFactory->addASTChild(currentAST, tmp33_AST);
601	–	match(COMMA);
602	–	doubleNumber();
603	–	astFactory->addASTChild( currentAST, returnAST );
604	–	ANTLR_USE_NAMESPACE(antlr)RefAST tmp34_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
605	–	tmp34_AST = astFactory->create(LT(1));
606	–	astFactory->addASTChild(currentAST, tmp34_AST);
595		match(RPAREN);
596		vectorConst_AST = currentAST.root;
597		}
#	Line 710 \| Line 698 \| void MDParser::atomblock() {
698		ANTLR_USE_NAMESPACE(antlr)RefAST atomblock_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
699
700		try { // for error handling
701	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp35_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
702	<	tmp35_AST = astFactory->create(LT(1));
703	<	astFactory->makeASTRoot(currentAST, tmp35_AST);
701	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp33_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
702	>	tmp33_AST = astFactory->create(LT(1));
703	>	astFactory->makeASTRoot(currentAST, tmp33_AST);
704		match(ATOM);
705		match(LBRACKET);
706		intConst();
#	Line 732 \| Line 720 \| void MDParser::atomblock() {
720		}
721		_loop31:;
722		} // ( ... )*
723	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp39_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
724	<	tmp39_AST = astFactory->create(LT(1));
725	<	astFactory->addASTChild(currentAST, tmp39_AST);
723	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp37_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
724	>	tmp37_AST = astFactory->create(LT(1));
725	>	astFactory->addASTChild(currentAST, tmp37_AST);
726		match(RCURLY);
727	<	#line 110 "MDParser.g"
728	<	tmp39_AST->setType(ENDBLOCK);
729	<	#line 742 "MDParser.cpp"
727	>	#line 128 "MDParser.g"
728	>	tmp37_AST->setType(ENDBLOCK);
729	>	#line 730 "MDParser.cpp"
730		atomblock_AST = currentAST.root;
731		}
732		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
#	Line 754 \| Line 742 \| void MDParser::bondblock() {
742		ANTLR_USE_NAMESPACE(antlr)RefAST bondblock_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
743
744		try { // for error handling
745	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp40_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
746	<	tmp40_AST = astFactory->create(LT(1));
747	<	astFactory->makeASTRoot(currentAST, tmp40_AST);
745	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp38_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
746	>	tmp38_AST = astFactory->create(LT(1));
747	>	astFactory->makeASTRoot(currentAST, tmp38_AST);
748		match(BOND);
749		{
750		switch ( LA(1)) {
#	Line 780 \| Line 768 \| void MDParser::bondblock() {
768		match(LCURLY);
769		{ // ( ... )*
770		for (;;) {
771	<	if ((LA(1) == MEMBERS \|\| LA(1) == ID)) {
771	>	if ((_tokenSet_10.member(LA(1)))) {
772		bondstatement();
773		astFactory->addASTChild( currentAST, returnAST );
774		}
#	Line 791 \| Line 779 \| void MDParser::bondblock() {
779		}
780		_loop36:;
781		} // ( ... )*
782	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp44_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
783	<	tmp44_AST = astFactory->create(LT(1));
784	<	astFactory->addASTChild(currentAST, tmp44_AST);
782	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp42_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
783	>	tmp42_AST = astFactory->create(LT(1));
784	>	astFactory->addASTChild(currentAST, tmp42_AST);
785		match(RCURLY);
786	<	#line 119 "MDParser.g"
787	<	tmp44_AST->setType(ENDBLOCK);
788	<	#line 801 "MDParser.cpp"
786	>	#line 138 "MDParser.g"
787	>	tmp42_AST->setType(ENDBLOCK);
788	>	#line 789 "MDParser.cpp"
789		bondblock_AST = currentAST.root;
790		}
791		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
#	Line 813 \| Line 801 \| void MDParser::bendblock() {
801		ANTLR_USE_NAMESPACE(antlr)RefAST bendblock_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
802
803		try { // for error handling
804	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp45_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
805	<	tmp45_AST = astFactory->create(LT(1));
806	<	astFactory->makeASTRoot(currentAST, tmp45_AST);
804	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp43_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
805	>	tmp43_AST = astFactory->create(LT(1));
806	>	astFactory->makeASTRoot(currentAST, tmp43_AST);
807		match(BEND);
808		{
809		switch ( LA(1)) {
#	Line 839 \| Line 827 \| void MDParser::bendblock() {
827		match(LCURLY);
828		{ // ( ... )*
829		for (;;) {
830	<	if ((LA(1) == MEMBERS \|\| LA(1) == ID)) {
830	>	if ((_tokenSet_11.member(LA(1)))) {
831		bendstatement();
832		astFactory->addASTChild( currentAST, returnAST );
833		}
#	Line 850 \| Line 838 \| void MDParser::bendblock() {
838		}
839		_loop41:;
840		} // ( ... )*
841	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp49_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
842	<	tmp49_AST = astFactory->create(LT(1));
843	<	astFactory->addASTChild(currentAST, tmp49_AST);
841	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp47_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
842	>	tmp47_AST = astFactory->create(LT(1));
843	>	astFactory->addASTChild(currentAST, tmp47_AST);
844		match(RCURLY);
845	<	#line 126 "MDParser.g"
846	<	tmp49_AST->setType(ENDBLOCK);
847	<	#line 860 "MDParser.cpp"
845	>	#line 151 "MDParser.g"
846	>	tmp47_AST->setType(ENDBLOCK);
847	>	#line 848 "MDParser.cpp"
848		bendblock_AST = currentAST.root;
849		}
850		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
#	Line 872 \| Line 860 \| void MDParser::torsionblock() {
860		ANTLR_USE_NAMESPACE(antlr)RefAST torsionblock_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
861
862		try { // for error handling
863	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp50_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
864	<	tmp50_AST = astFactory->create(LT(1));
865	<	astFactory->makeASTRoot(currentAST, tmp50_AST);
863	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp48_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
864	>	tmp48_AST = astFactory->create(LT(1));
865	>	astFactory->makeASTRoot(currentAST, tmp48_AST);
866		match(TORSION);
867		{
868		switch ( LA(1)) {
#	Line 898 \| Line 886 \| void MDParser::torsionblock() {
886		match(LCURLY);
887		{ // ( ... )*
888		for (;;) {
889	<	if ((LA(1) == MEMBERS \|\| LA(1) == ID)) {
889	>	if ((_tokenSet_12.member(LA(1)))) {
890		torsionstatement();
891		astFactory->addASTChild( currentAST, returnAST );
892		}
#	Line 909 \| Line 897 \| void MDParser::torsionblock() {
897		}
898		_loop46:;
899		} // ( ... )*
900	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp54_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
901	<	tmp54_AST = astFactory->create(LT(1));
902	<	astFactory->addASTChild(currentAST, tmp54_AST);
900	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp52_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
901	>	tmp52_AST = astFactory->create(LT(1));
902	>	astFactory->addASTChild(currentAST, tmp52_AST);
903		match(RCURLY);
904	<	#line 133 "MDParser.g"
905	<	tmp54_AST->setType(ENDBLOCK);
906	<	#line 919 "MDParser.cpp"
904	>	#line 165 "MDParser.g"
905	>	tmp52_AST->setType(ENDBLOCK);
906	>	#line 907 "MDParser.cpp"
907		torsionblock_AST = currentAST.root;
908		}
909		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
#	Line 931 \| Line 919 \| void MDParser::inversionblock() {
919		ANTLR_USE_NAMESPACE(antlr)RefAST inversionblock_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
920
921		try { // for error handling
922	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp55_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
923	<	tmp55_AST = astFactory->create(LT(1));
924	<	astFactory->makeASTRoot(currentAST, tmp55_AST);
922	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp53_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
923	>	tmp53_AST = astFactory->create(LT(1));
924	>	astFactory->makeASTRoot(currentAST, tmp53_AST);
925		match(INVERSION);
926		{
927		switch ( LA(1)) {
#	Line 957 \| Line 945 \| void MDParser::inversionblock() {
945		match(LCURLY);
946		{ // ( ... )*
947		for (;;) {
948	<	if ((_tokenSet_10.member(LA(1)))) {
948	>	if ((_tokenSet_13.member(LA(1)))) {
949		inversionstatement();
950		astFactory->addASTChild( currentAST, returnAST );
951		}
#	Line 968 \| Line 956 \| void MDParser::inversionblock() {
956		}
957		_loop51:;
958		} // ( ... )*
959	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp59_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
960	<	tmp59_AST = astFactory->create(LT(1));
961	<	astFactory->addASTChild(currentAST, tmp59_AST);
959	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp57_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
960	>	tmp57_AST = astFactory->create(LT(1));
961	>	astFactory->addASTChild(currentAST, tmp57_AST);
962		match(RCURLY);
963	<	#line 140 "MDParser.g"
964	<	tmp59_AST->setType(ENDBLOCK);
965	<	#line 978 "MDParser.cpp"
963	>	#line 180 "MDParser.g"
964	>	tmp57_AST->setType(ENDBLOCK);
965	>	#line 966 "MDParser.cpp"
966		inversionblock_AST = currentAST.root;
967		}
968		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
#	Line 990 \| Line 978 \| void MDParser::rigidbodyblock() {
978		ANTLR_USE_NAMESPACE(antlr)RefAST rigidbodyblock_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
979
980		try { // for error handling
981	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp60_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
982	<	tmp60_AST = astFactory->create(LT(1));
983	<	astFactory->makeASTRoot(currentAST, tmp60_AST);
981	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp58_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
982	>	tmp58_AST = astFactory->create(LT(1));
983	>	astFactory->makeASTRoot(currentAST, tmp58_AST);
984		match(RIGIDBODY);
985		match(LBRACKET);
986		intConst();
#	Line 1012 \| Line 1000 \| void MDParser::rigidbodyblock() {
1000		}
1001		_loop55:;
1002		} // ( ... )*
1003	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp64_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1004	<	tmp64_AST = astFactory->create(LT(1));
1005	<	astFactory->addASTChild(currentAST, tmp64_AST);
1003	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp62_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1004	>	tmp62_AST = astFactory->create(LT(1));
1005	>	astFactory->addASTChild(currentAST, tmp62_AST);
1006		match(RCURLY);
1007	<	#line 148 "MDParser.g"
1008	<	tmp64_AST->setType(ENDBLOCK);
1009	<	#line 1022 "MDParser.cpp"
1007	>	#line 193 "MDParser.g"
1008	>	tmp62_AST->setType(ENDBLOCK);
1009	>	#line 1010 "MDParser.cpp"
1010		rigidbodyblock_AST = currentAST.root;
1011		}
1012		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
#	Line 1034 \| Line 1022 \| void MDParser::cutoffgroupblock() {
1022		ANTLR_USE_NAMESPACE(antlr)RefAST cutoffgroupblock_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1023
1024		try { // for error handling
1025	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp65_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1026	<	tmp65_AST = astFactory->create(LT(1));
1027	<	astFactory->makeASTRoot(currentAST, tmp65_AST);
1025	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp63_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1026	>	tmp63_AST = astFactory->create(LT(1));
1027	>	astFactory->makeASTRoot(currentAST, tmp63_AST);
1028		match(CUTOFFGROUP);
1029		{
1030		switch ( LA(1)) {
#	Line 1071 \| Line 1059 \| void MDParser::cutoffgroupblock() {
1059		}
1060		_loop60:;
1061		} // ( ... )*
1062	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp69_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1063	<	tmp69_AST = astFactory->create(LT(1));
1064	<	astFactory->addASTChild(currentAST, tmp69_AST);
1062	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp67_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1063	>	tmp67_AST = astFactory->create(LT(1));
1064	>	astFactory->addASTChild(currentAST, tmp67_AST);
1065		match(RCURLY);
1066	<	#line 155 "MDParser.g"
1067	<	tmp69_AST->setType(ENDBLOCK);
1068	<	#line 1081 "MDParser.cpp"
1066	>	#line 200 "MDParser.g"
1067	>	tmp67_AST->setType(ENDBLOCK);
1068	>	#line 1069 "MDParser.cpp"
1069		cutoffgroupblock_AST = currentAST.root;
1070		}
1071		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
#	Line 1093 \| Line 1081 \| void MDParser::fragmentblock() {
1081		ANTLR_USE_NAMESPACE(antlr)RefAST fragmentblock_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1082
1083		try { // for error handling
1084	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp70_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1085	<	tmp70_AST = astFactory->create(LT(1));
1086	<	astFactory->makeASTRoot(currentAST, tmp70_AST);
1084	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp68_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1085	>	tmp68_AST = astFactory->create(LT(1));
1086	>	astFactory->makeASTRoot(currentAST, tmp68_AST);
1087		match(FRAGMENT);
1088		match(LBRACKET);
1089		intConst();
#	Line 1115 \| Line 1103 \| void MDParser::fragmentblock() {
1103		}
1104		_loop64:;
1105		} // ( ... )*
1106	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp74_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1107	<	tmp74_AST = astFactory->create(LT(1));
1108	<	astFactory->addASTChild(currentAST, tmp74_AST);
1106	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp72_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1107	>	tmp72_AST = astFactory->create(LT(1));
1108	>	astFactory->addASTChild(currentAST, tmp72_AST);
1109		match(RCURLY);
1110	<	#line 162 "MDParser.g"
1111	<	tmp74_AST->setType(ENDBLOCK);
1112	<	#line 1125 "MDParser.cpp"
1110	>	#line 207 "MDParser.g"
1111	>	tmp72_AST->setType(ENDBLOCK);
1112	>	#line 1113 "MDParser.cpp"
1113		fragmentblock_AST = currentAST.root;
1114		}
1115		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
#	Line 1137 \| Line 1125 \| void MDParser::constraintblock() {
1125		ANTLR_USE_NAMESPACE(antlr)RefAST constraintblock_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1126
1127		try { // for error handling
1128	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp75_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1129	<	tmp75_AST = astFactory->create(LT(1));
1130	<	astFactory->makeASTRoot(currentAST, tmp75_AST);
1128	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp73_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1129	>	tmp73_AST = astFactory->create(LT(1));
1130	>	astFactory->makeASTRoot(currentAST, tmp73_AST);
1131		match(CONSTRAINT);
1132		{
1133		switch ( LA(1)) {
#	Line 1174 \| Line 1162 \| void MDParser::constraintblock() {
1162		}
1163		_loop69:;
1164		} // ( ... )*
1165	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp79_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1166	<	tmp79_AST = astFactory->create(LT(1));
1167	<	astFactory->addASTChild(currentAST, tmp79_AST);
1165	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp77_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1166	>	tmp77_AST = astFactory->create(LT(1));
1167	>	astFactory->addASTChild(currentAST, tmp77_AST);
1168		match(RCURLY);
1169	<	#line 168 "MDParser.g"
1170	<	tmp79_AST->setType(ENDBLOCK);
1171	<	#line 1184 "MDParser.cpp"
1169	>	#line 213 "MDParser.g"
1170	>	tmp77_AST->setType(ENDBLOCK);
1171	>	#line 1172 "MDParser.cpp"
1172		constraintblock_AST = currentAST.root;
1173		}
1174		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
#	Line 1206 \| Line 1194 \| void MDParser::atomstatement() {
1194		}
1195		case POSITION:
1196		{
1197	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp80_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1198	<	tmp80_AST = astFactory->create(LT(1));
1199	<	astFactory->makeASTRoot(currentAST, tmp80_AST);
1197	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp78_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1198	>	tmp78_AST = astFactory->create(LT(1));
1199	>	astFactory->makeASTRoot(currentAST, tmp78_AST);
1200		match(POSITION);
1201		match(LPAREN);
1202		doubleNumberTuple();
#	Line 1220 \| Line 1208 \| void MDParser::atomstatement() {
1208		}
1209		case ORIENTATION:
1210		{
1211	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp84_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1212	<	tmp84_AST = astFactory->create(LT(1));
1213	<	astFactory->makeASTRoot(currentAST, tmp84_AST);
1211	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp82_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1212	>	tmp82_AST = astFactory->create(LT(1));
1213	>	astFactory->makeASTRoot(currentAST, tmp82_AST);
1214		match(ORIENTATION);
1215		match(LPAREN);
1216		doubleNumberTuple();
#	Line 1232 \| Line 1220 \| void MDParser::atomstatement() {
1220		atomstatement_AST = currentAST.root;
1221		break;
1222		}
1223	+	case CHARGE:
1224	+	{
1225	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp86_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1226	+	tmp86_AST = astFactory->create(LT(1));
1227	+	astFactory->makeASTRoot(currentAST, tmp86_AST);
1228	+	match(CHARGE);
1229	+	match(LPAREN);
1230	+	floatConst();
1231	+	astFactory->addASTChild( currentAST, returnAST );
1232	+	match(RPAREN);
1233	+	match(SEMICOLON);
1234	+	atomstatement_AST = currentAST.root;
1235	+	break;
1236	+	}
1237		default:
1238		{
1239		throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(LT(1), getFilename());
#	Line 1240 \| Line 1242 \| void MDParser::atomstatement() {
1242		}
1243		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1244		reportError(ex);
1245	<	recover(ex,_tokenSet_11);
1245	>	recover(ex,_tokenSet_14);
1246		}
1247		returnAST = atomstatement_AST;
1248		}
#	Line 1271 \| Line 1273 \| void MDParser::doubleNumberTuple() {
1273		}
1274		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1275		reportError(ex);
1276	<	recover(ex,_tokenSet_12);
1276	>	recover(ex,_tokenSet_15);
1277		}
1278		returnAST = doubleNumberTuple_AST;
1279		}
#	Line 1292 \| Line 1294 \| void MDParser::bondstatement() {
1294		}
1295		case MEMBERS:
1296		{
1297	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp89_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1298	<	tmp89_AST = astFactory->create(LT(1));
1299	<	astFactory->makeASTRoot(currentAST, tmp89_AST);
1297	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp91_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1298	>	tmp91_AST = astFactory->create(LT(1));
1299	>	astFactory->makeASTRoot(currentAST, tmp91_AST);
1300		match(MEMBERS);
1301		match(LPAREN);
1302		inttuple();
1303	+	astFactory->addASTChild( currentAST, returnAST );
1304	+	match(RPAREN);
1305	+	match(SEMICOLON);
1306	+	bondstatement_AST = currentAST.root;
1307	+	break;
1308	+	}
1309	+	case FIXED:
1310	+	{
1311	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp95_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1312	+	tmp95_AST = astFactory->create(LT(1));
1313	+	astFactory->makeASTRoot(currentAST, tmp95_AST);
1314	+	match(FIXED);
1315	+	match(LPAREN);
1316	+	floatConst();
1317	+	astFactory->addASTChild( currentAST, returnAST );
1318	+	match(RPAREN);
1319	+	match(SEMICOLON);
1320	+	bondstatement_AST = currentAST.root;
1321	+	break;
1322	+	}
1323	+	case HARMONIC:
1324	+	{
1325	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp99_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1326	+	tmp99_AST = astFactory->create(LT(1));
1327	+	astFactory->makeASTRoot(currentAST, tmp99_AST);
1328	+	match(HARMONIC);
1329	+	match(LPAREN);
1330	+	doubleNumberTuple();
1331	+	astFactory->addASTChild( currentAST, returnAST );
1332	+	match(RPAREN);
1333	+	match(SEMICOLON);
1334	+	bondstatement_AST = currentAST.root;
1335	+	break;
1336	+	}
1337	+	case CUBIC:
1338	+	{
1339	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp103_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1340	+	tmp103_AST = astFactory->create(LT(1));
1341	+	astFactory->makeASTRoot(currentAST, tmp103_AST);
1342	+	match(CUBIC);
1343	+	match(LPAREN);
1344	+	doubleNumberTuple();
1345	+	astFactory->addASTChild( currentAST, returnAST );
1346	+	match(RPAREN);
1347	+	match(SEMICOLON);
1348	+	bondstatement_AST = currentAST.root;
1349	+	break;
1350	+	}
1351	+	case QUARTIC:
1352	+	{
1353	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp107_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1354	+	tmp107_AST = astFactory->create(LT(1));
1355	+	astFactory->makeASTRoot(currentAST, tmp107_AST);
1356	+	match(QUARTIC);
1357	+	match(LPAREN);
1358	+	doubleNumberTuple();
1359	+	astFactory->addASTChild( currentAST, returnAST );
1360	+	match(RPAREN);
1361	+	match(SEMICOLON);
1362	+	bondstatement_AST = currentAST.root;
1363	+	break;
1364	+	}
1365	+	case POLYNOMIAL:
1366	+	{
1367	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp111_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1368	+	tmp111_AST = astFactory->create(LT(1));
1369	+	astFactory->makeASTRoot(currentAST, tmp111_AST);
1370	+	match(POLYNOMIAL);
1371	+	match(LPAREN);
1372	+	doubleNumberTuple();
1373		astFactory->addASTChild( currentAST, returnAST );
1374		match(RPAREN);
1375		match(SEMICOLON);
1376		bondstatement_AST = currentAST.root;
1377		break;
1378		}
1379	+	case MORSE:
1380	+	{
1381	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp115_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1382	+	tmp115_AST = astFactory->create(LT(1));
1383	+	astFactory->makeASTRoot(currentAST, tmp115_AST);
1384	+	match(MORSE);
1385	+	match(LPAREN);
1386	+	doubleNumberTuple();
1387	+	astFactory->addASTChild( currentAST, returnAST );
1388	+	match(RPAREN);
1389	+	match(SEMICOLON);
1390	+	bondstatement_AST = currentAST.root;
1391	+	break;
1392	+	}
1393		default:
1394		{
1395		throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(LT(1), getFilename());
#	Line 1312 \| Line 1398 \| void MDParser::bondstatement() {
1398		}
1399		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1400		reportError(ex);
1401	<	recover(ex,_tokenSet_13);
1401	>	recover(ex,_tokenSet_16);
1402		}
1403		returnAST = bondstatement_AST;
1404		}
#	Line 1343 \| Line 1429 \| void MDParser::inttuple() {
1429		}
1430		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1431		reportError(ex);
1432	<	recover(ex,_tokenSet_12);
1432	>	recover(ex,_tokenSet_15);
1433		}
1434		returnAST = inttuple_AST;
1435		}
#	Line 1364 \| Line 1450 \| void MDParser::bendstatement() {
1450		}
1451		case MEMBERS:
1452		{
1453	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp94_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1454	<	tmp94_AST = astFactory->create(LT(1));
1455	<	astFactory->makeASTRoot(currentAST, tmp94_AST);
1453	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp120_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1454	>	tmp120_AST = astFactory->create(LT(1));
1455	>	astFactory->makeASTRoot(currentAST, tmp120_AST);
1456		match(MEMBERS);
1457		match(LPAREN);
1458		inttuple();
#	Line 1376 \| Line 1462 \| void MDParser::bendstatement() {
1462		bendstatement_AST = currentAST.root;
1463		break;
1464		}
1465	+	case HARMONIC:
1466	+	{
1467	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp124_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1468	+	tmp124_AST = astFactory->create(LT(1));
1469	+	astFactory->makeASTRoot(currentAST, tmp124_AST);
1470	+	match(HARMONIC);
1471	+	match(LPAREN);
1472	+	doubleNumberTuple();
1473	+	astFactory->addASTChild( currentAST, returnAST );
1474	+	match(RPAREN);
1475	+	match(SEMICOLON);
1476	+	bendstatement_AST = currentAST.root;
1477	+	break;
1478	+	}
1479	+	case GHOSTBEND:
1480	+	{
1481	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp128_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1482	+	tmp128_AST = astFactory->create(LT(1));
1483	+	astFactory->makeASTRoot(currentAST, tmp128_AST);
1484	+	match(GHOSTBEND);
1485	+	match(LPAREN);
1486	+	doubleNumberTuple();
1487	+	astFactory->addASTChild( currentAST, returnAST );
1488	+	match(RPAREN);
1489	+	match(SEMICOLON);
1490	+	bendstatement_AST = currentAST.root;
1491	+	break;
1492	+	}
1493	+	case UREYBRADLEY:
1494	+	{
1495	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp132_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1496	+	tmp132_AST = astFactory->create(LT(1));
1497	+	astFactory->makeASTRoot(currentAST, tmp132_AST);
1498	+	match(UREYBRADLEY);
1499	+	match(LPAREN);
1500	+	doubleNumberTuple();
1501	+	astFactory->addASTChild( currentAST, returnAST );
1502	+	match(RPAREN);
1503	+	match(SEMICOLON);
1504	+	bendstatement_AST = currentAST.root;
1505	+	break;
1506	+	}
1507	+	case CUBIC:
1508	+	{
1509	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp136_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1510	+	tmp136_AST = astFactory->create(LT(1));
1511	+	astFactory->makeASTRoot(currentAST, tmp136_AST);
1512	+	match(CUBIC);
1513	+	match(LPAREN);
1514	+	doubleNumberTuple();
1515	+	astFactory->addASTChild( currentAST, returnAST );
1516	+	match(RPAREN);
1517	+	match(SEMICOLON);
1518	+	bendstatement_AST = currentAST.root;
1519	+	break;
1520	+	}
1521	+	case QUARTIC:
1522	+	{
1523	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp140_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1524	+	tmp140_AST = astFactory->create(LT(1));
1525	+	astFactory->makeASTRoot(currentAST, tmp140_AST);
1526	+	match(QUARTIC);
1527	+	match(LPAREN);
1528	+	doubleNumberTuple();
1529	+	astFactory->addASTChild( currentAST, returnAST );
1530	+	match(RPAREN);
1531	+	match(SEMICOLON);
1532	+	bendstatement_AST = currentAST.root;
1533	+	break;
1534	+	}
1535	+	case POLYNOMIAL:
1536	+	{
1537	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp144_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1538	+	tmp144_AST = astFactory->create(LT(1));
1539	+	astFactory->makeASTRoot(currentAST, tmp144_AST);
1540	+	match(POLYNOMIAL);
1541	+	match(LPAREN);
1542	+	doubleNumberTuple();
1543	+	astFactory->addASTChild( currentAST, returnAST );
1544	+	match(RPAREN);
1545	+	match(SEMICOLON);
1546	+	bendstatement_AST = currentAST.root;
1547	+	break;
1548	+	}
1549	+	case COSINE:
1550	+	{
1551	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp148_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1552	+	tmp148_AST = astFactory->create(LT(1));
1553	+	astFactory->makeASTRoot(currentAST, tmp148_AST);
1554	+	match(COSINE);
1555	+	match(LPAREN);
1556	+	doubleNumberTuple();
1557	+	astFactory->addASTChild( currentAST, returnAST );
1558	+	match(RPAREN);
1559	+	match(SEMICOLON);
1560	+	bendstatement_AST = currentAST.root;
1561	+	break;
1562	+	}
1563		default:
1564		{
1565		throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(LT(1), getFilename());
#	Line 1384 \| Line 1568 \| void MDParser::bendstatement() {
1568		}
1569		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1570		reportError(ex);
1571	<	recover(ex,_tokenSet_13);
1571	>	recover(ex,_tokenSet_17);
1572		}
1573		returnAST = bendstatement_AST;
1574		}
#	Line 1405 \| Line 1589 \| void MDParser::torsionstatement() {
1589		}
1590		case MEMBERS:
1591		{
1592	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp98_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1593	<	tmp98_AST = astFactory->create(LT(1));
1594	<	astFactory->makeASTRoot(currentAST, tmp98_AST);
1592	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp152_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1593	>	tmp152_AST = astFactory->create(LT(1));
1594	>	astFactory->makeASTRoot(currentAST, tmp152_AST);
1595		match(MEMBERS);
1596		match(LPAREN);
1597		inttuple();
#	Line 1417 \| Line 1601 \| void MDParser::torsionstatement() {
1601		torsionstatement_AST = currentAST.root;
1602		break;
1603		}
1604	+	case GHOSTTORSION:
1605	+	{
1606	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp156_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1607	+	tmp156_AST = astFactory->create(LT(1));
1608	+	astFactory->makeASTRoot(currentAST, tmp156_AST);
1609	+	match(GHOSTTORSION);
1610	+	match(LPAREN);
1611	+	doubleNumberTuple();
1612	+	astFactory->addASTChild( currentAST, returnAST );
1613	+	match(RPAREN);
1614	+	match(SEMICOLON);
1615	+	torsionstatement_AST = currentAST.root;
1616	+	break;
1617	+	}
1618	+	case CUBIC:
1619	+	{
1620	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp160_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1621	+	tmp160_AST = astFactory->create(LT(1));
1622	+	astFactory->makeASTRoot(currentAST, tmp160_AST);
1623	+	match(CUBIC);
1624	+	match(LPAREN);
1625	+	doubleNumberTuple();
1626	+	astFactory->addASTChild( currentAST, returnAST );
1627	+	match(RPAREN);
1628	+	match(SEMICOLON);
1629	+	torsionstatement_AST = currentAST.root;
1630	+	break;
1631	+	}
1632	+	case QUARTIC:
1633	+	{
1634	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp164_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1635	+	tmp164_AST = astFactory->create(LT(1));
1636	+	astFactory->makeASTRoot(currentAST, tmp164_AST);
1637	+	match(QUARTIC);
1638	+	match(LPAREN);
1639	+	doubleNumberTuple();
1640	+	astFactory->addASTChild( currentAST, returnAST );
1641	+	match(RPAREN);
1642	+	match(SEMICOLON);
1643	+	torsionstatement_AST = currentAST.root;
1644	+	break;
1645	+	}
1646	+	case POLYNOMIAL:
1647	+	{
1648	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp168_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1649	+	tmp168_AST = astFactory->create(LT(1));
1650	+	astFactory->makeASTRoot(currentAST, tmp168_AST);
1651	+	match(POLYNOMIAL);
1652	+	match(LPAREN);
1653	+	doubleNumberTuple();
1654	+	astFactory->addASTChild( currentAST, returnAST );
1655	+	match(RPAREN);
1656	+	match(SEMICOLON);
1657	+	torsionstatement_AST = currentAST.root;
1658	+	break;
1659	+	}
1660	+	case CHARMM:
1661	+	{
1662	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp172_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1663	+	tmp172_AST = astFactory->create(LT(1));
1664	+	astFactory->makeASTRoot(currentAST, tmp172_AST);
1665	+	match(CHARMM);
1666	+	match(LPAREN);
1667	+	doubleNumberTuple();
1668	+	astFactory->addASTChild( currentAST, returnAST );
1669	+	match(RPAREN);
1670	+	match(SEMICOLON);
1671	+	torsionstatement_AST = currentAST.root;
1672	+	break;
1673	+	}
1674	+	case OPLS:
1675	+	{
1676	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp176_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1677	+	tmp176_AST = astFactory->create(LT(1));
1678	+	astFactory->makeASTRoot(currentAST, tmp176_AST);
1679	+	match(OPLS);
1680	+	match(LPAREN);
1681	+	doubleNumberTuple();
1682	+	astFactory->addASTChild( currentAST, returnAST );
1683	+	match(RPAREN);
1684	+	match(SEMICOLON);
1685	+	torsionstatement_AST = currentAST.root;
1686	+	break;
1687	+	}
1688	+	case TRAPPE:
1689	+	{
1690	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp180_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1691	+	tmp180_AST = astFactory->create(LT(1));
1692	+	astFactory->makeASTRoot(currentAST, tmp180_AST);
1693	+	match(TRAPPE);
1694	+	match(LPAREN);
1695	+	doubleNumberTuple();
1696	+	astFactory->addASTChild( currentAST, returnAST );
1697	+	match(RPAREN);
1698	+	match(SEMICOLON);
1699	+	torsionstatement_AST = currentAST.root;
1700	+	break;
1701	+	}
1702	+	case HARMONIC:
1703	+	{
1704	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp184_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1705	+	tmp184_AST = astFactory->create(LT(1));
1706	+	astFactory->makeASTRoot(currentAST, tmp184_AST);
1707	+	match(HARMONIC);
1708	+	match(LPAREN);
1709	+	doubleNumberTuple();
1710	+	astFactory->addASTChild( currentAST, returnAST );
1711	+	match(RPAREN);
1712	+	match(SEMICOLON);
1713	+	torsionstatement_AST = currentAST.root;
1714	+	break;
1715	+	}
1716		default:
1717		{
1718		throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(LT(1), getFilename());
#	Line 1425 \| Line 1721 \| void MDParser::torsionstatement() {
1721		}
1722		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1723		reportError(ex);
1724	<	recover(ex,_tokenSet_13);
1724	>	recover(ex,_tokenSet_18);
1725		}
1726		returnAST = torsionstatement_AST;
1727		}
#	Line 1446 \| Line 1742 \| void MDParser::inversionstatement() {
1742		}
1743		case CENTER:
1744		{
1745	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp102_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1746	<	tmp102_AST = astFactory->create(LT(1));
1747	<	astFactory->makeASTRoot(currentAST, tmp102_AST);
1745	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp188_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1746	>	tmp188_AST = astFactory->create(LT(1));
1747	>	astFactory->makeASTRoot(currentAST, tmp188_AST);
1748		match(CENTER);
1749		match(LPAREN);
1750		intConst();
#	Line 1460 \| Line 1756 \| void MDParser::inversionstatement() {
1756		}
1757		case SATELLITES:
1758		{
1759	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp106_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1760	<	tmp106_AST = astFactory->create(LT(1));
1761	<	astFactory->makeASTRoot(currentAST, tmp106_AST);
1759	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp192_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1760	>	tmp192_AST = astFactory->create(LT(1));
1761	>	astFactory->makeASTRoot(currentAST, tmp192_AST);
1762		match(SATELLITES);
1763		match(LPAREN);
1764		inttuple();
#	Line 1472 \| Line 1768 \| void MDParser::inversionstatement() {
1768		inversionstatement_AST = currentAST.root;
1769		break;
1770		}
1771	+	case AMBERIMPROPER:
1772	+	{
1773	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp196_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1774	+	tmp196_AST = astFactory->create(LT(1));
1775	+	astFactory->makeASTRoot(currentAST, tmp196_AST);
1776	+	match(AMBERIMPROPER);
1777	+	match(LPAREN);
1778	+	doubleNumberTuple();
1779	+	astFactory->addASTChild( currentAST, returnAST );
1780	+	match(RPAREN);
1781	+	match(SEMICOLON);
1782	+	inversionstatement_AST = currentAST.root;
1783	+	break;
1784	+	}
1785	+	case IMPROPERCOSINE:
1786	+	{
1787	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp200_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1788	+	tmp200_AST = astFactory->create(LT(1));
1789	+	astFactory->makeASTRoot(currentAST, tmp200_AST);
1790	+	match(IMPROPERCOSINE);
1791	+	match(LPAREN);
1792	+	doubleNumberTuple();
1793	+	astFactory->addASTChild( currentAST, returnAST );
1794	+	match(RPAREN);
1795	+	match(SEMICOLON);
1796	+	inversionstatement_AST = currentAST.root;
1797	+	break;
1798	+	}
1799	+	case HARMONIC:
1800	+	{
1801	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp204_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1802	+	tmp204_AST = astFactory->create(LT(1));
1803	+	astFactory->makeASTRoot(currentAST, tmp204_AST);
1804	+	match(HARMONIC);
1805	+	match(LPAREN);
1806	+	doubleNumberTuple();
1807	+	astFactory->addASTChild( currentAST, returnAST );
1808	+	match(RPAREN);
1809	+	match(SEMICOLON);
1810	+	inversionstatement_AST = currentAST.root;
1811	+	break;
1812	+	}
1813	+	case CENTRALATOMHEIGHT:
1814	+	{
1815	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp208_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1816	+	tmp208_AST = astFactory->create(LT(1));
1817	+	astFactory->makeASTRoot(currentAST, tmp208_AST);
1818	+	match(CENTRALATOMHEIGHT);
1819	+	match(LPAREN);
1820	+	doubleNumberTuple();
1821	+	astFactory->addASTChild( currentAST, returnAST );
1822	+	match(RPAREN);
1823	+	match(SEMICOLON);
1824	+	inversionstatement_AST = currentAST.root;
1825	+	break;
1826	+	}
1827	+	case DREIDING:
1828	+	{
1829	+	ANTLR_USE_NAMESPACE(antlr)RefAST tmp212_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1830	+	tmp212_AST = astFactory->create(LT(1));
1831	+	astFactory->makeASTRoot(currentAST, tmp212_AST);
1832	+	match(DREIDING);
1833	+	match(LPAREN);
1834	+	doubleNumberTuple();
1835	+	astFactory->addASTChild( currentAST, returnAST );
1836	+	match(RPAREN);
1837	+	match(SEMICOLON);
1838	+	inversionstatement_AST = currentAST.root;
1839	+	break;
1840	+	}
1841		default:
1842		{
1843		throw ANTLR_USE_NAMESPACE(antlr)NoViableAltException(LT(1), getFilename());
#	Line 1480 \| Line 1846 \| void MDParser::inversionstatement() {
1846		}
1847		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1848		reportError(ex);
1849	<	recover(ex,_tokenSet_14);
1849	>	recover(ex,_tokenSet_19);
1850		}
1851		returnAST = inversionstatement_AST;
1852		}
#	Line 1501 \| Line 1867 \| void MDParser::rigidbodystatement() {
1867		}
1868		case MEMBERS:
1869		{
1870	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp110_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1871	<	tmp110_AST = astFactory->create(LT(1));
1872	<	astFactory->makeASTRoot(currentAST, tmp110_AST);
1870	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp216_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1871	>	tmp216_AST = astFactory->create(LT(1));
1872	>	astFactory->makeASTRoot(currentAST, tmp216_AST);
1873		match(MEMBERS);
1874		match(LPAREN);
1875		inttuple();
#	Line 1521 \| Line 1887 \| void MDParser::rigidbodystatement() {
1887		}
1888		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1889		reportError(ex);
1890	<	recover(ex,_tokenSet_13);
1890	>	recover(ex,_tokenSet_20);
1891		}
1892		returnAST = rigidbodystatement_AST;
1893		}
#	Line 1542 \| Line 1908 \| void MDParser::cutoffgroupstatement() {
1908		}
1909		case MEMBERS:
1910		{
1911	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp114_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1912	<	tmp114_AST = astFactory->create(LT(1));
1913	<	astFactory->makeASTRoot(currentAST, tmp114_AST);
1911	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp220_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1912	>	tmp220_AST = astFactory->create(LT(1));
1913	>	astFactory->makeASTRoot(currentAST, tmp220_AST);
1914		match(MEMBERS);
1915		match(LPAREN);
1916		inttuple();
#	Line 1562 \| Line 1928 \| void MDParser::cutoffgroupstatement() {
1928		}
1929		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1930		reportError(ex);
1931	<	recover(ex,_tokenSet_13);
1931	>	recover(ex,_tokenSet_20);
1932		}
1933		returnAST = cutoffgroupstatement_AST;
1934		}
#	Line 1579 \| Line 1945 \| void MDParser::fragmentstatement() {
1945		}
1946		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1947		reportError(ex);
1948	<	recover(ex,_tokenSet_15);
1948	>	recover(ex,_tokenSet_21);
1949		}
1950		returnAST = fragmentstatement_AST;
1951		}
#	Line 1600 \| Line 1966 \| void MDParser::constraintstatement() {
1966		}
1967		case MEMBERS:
1968		{
1969	<	ANTLR_USE_NAMESPACE(antlr)RefAST tmp118_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1970	<	tmp118_AST = astFactory->create(LT(1));
1971	<	astFactory->makeASTRoot(currentAST, tmp118_AST);
1969	>	ANTLR_USE_NAMESPACE(antlr)RefAST tmp224_AST = ANTLR_USE_NAMESPACE(antlr)nullAST;
1970	>	tmp224_AST = astFactory->create(LT(1));
1971	>	astFactory->makeASTRoot(currentAST, tmp224_AST);
1972		match(MEMBERS);
1973		match(LPAREN);
1974		inttuple();
#	Line 1620 \| Line 1986 \| void MDParser::constraintstatement() {
1986		}
1987		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
1988		reportError(ex);
1989	<	recover(ex,_tokenSet_13);
1989	>	recover(ex,_tokenSet_20);
1990		}
1991		returnAST = constraintstatement_AST;
1992		}
#	Line 1657 \| Line 2023 \| void MDParser::doubleNumber() {
2023		}
2024		catch (ANTLR_USE_NAMESPACE(antlr)RecognitionException& ex) {
2025		reportError(ex);
2026	<	recover(ex,_tokenSet_16);
2026	>	recover(ex,_tokenSet_22);
2027		}
2028		returnAST = doubleNumber_AST;
2029		}
2030
2031		void MDParser::initializeASTFactory( ANTLR_USE_NAMESPACE(antlr)ASTFactory& factory )
2032		{
2033	<	factory.setMaxNodeType(59);
2033	>	factory.setMaxNodeType(77);
2034		}
2035		const char* MDParser::tokenNames[] = {
2036		"<0>",
#	Line 1693 \| Line 2059 \| *const char MDParser::tokenNames[] = {**
2059		"\"flucQ\"",
2060		"\"RNEMD\"",
2061		"\"minimizer\"",
2062	+	"\"Fixed\"",
2063	+	"\"Harmonic\"",
2064	+	"\"Cubic\"",
2065	+	"\"Quartic\"",
2066	+	"\"Polynomial\"",
2067	+	"\"Morse\"",
2068	+	"\"GhostBend\"",
2069	+	"\"UreyBradley\"",
2070	+	"\"Cosine\"",
2071	+	"\"GhostTorsion\"",
2072	+	"\"Charmm\"",
2073	+	"\"Opls\"",
2074	+	"\"Trappe\"",
2075	+	"\"AmberImproper\"",
2076	+	"\"ImproperCosine\"",
2077	+	"\"CentralAtomHeight\"",
2078	+	"\"Dreiding\"",
2079	+	"\"charge\"",
2080		"ENDBLOCK",
2081		"ID",
2082		"ASSIGNEQUAL",
#	Line 1730 \| Line 2114 \| *const char MDParser::tokenNames[] = {**
2114		0
2115		};
2116
2117	<	const unsigned long MDParser::_tokenSet_0_data_[] = { 192938224UL, 0UL, 0UL, 0UL };
2117	>	const unsigned long MDParser::_tokenSet_0_data_[] = { 58720496UL, 8192UL, 0UL, 0UL };
2118		// "component" "molecule" "zconstraint" "restraint" "flucQ" "RNEMD" "minimizer"
2119		// ID
2120		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_0(_tokenSet_0_data_,4);
2121		const unsigned long MDParser::_tokenSet_1_data_[] = { 2UL, 0UL, 0UL, 0UL };
2122		// EOF
2123		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_1(_tokenSet_1_data_,4);
2124	<	const unsigned long MDParser::_tokenSet_2_data_[] = { 192938226UL, 0UL, 0UL, 0UL };
2124	>	const unsigned long MDParser::_tokenSet_2_data_[] = { 58720498UL, 8192UL, 0UL, 0UL };
2125		// EOF "component" "molecule" "zconstraint" "restraint" "flucQ" "RNEMD"
2126		// "minimizer" ID
2127		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_2(_tokenSet_2_data_,4);
2128	<	const unsigned long MDParser::_tokenSet_3_data_[] = { 201261042UL, 1UL, 0UL, 0UL };
2128	>	const unsigned long MDParser::_tokenSet_3_data_[] = { 4294901746UL, 274431UL, 0UL, 0UL };
2129		// EOF "component" "molecule" "zconstraint" "restraint" "atom" "bond" "bend"
2130		// "torsion" "inversion" "rigidBody" "cutoffGroup" "constraint" "fragment"
2131		// "members" "center" "satellites" "position" "orientation" "flucQ" "RNEMD"
2132	<	// "minimizer" ID RCURLY
2132	>	// "minimizer" "Fixed" "Harmonic" "Cubic" "Quartic" "Polynomial" "Morse"
2133	>	// "GhostBend" "UreyBradley" "Cosine" "GhostTorsion" "Charmm" "Opls" "Trappe"
2134	>	// "AmberImproper" "ImproperCosine" "CentralAtomHeight" "Dreiding" "charge"
2135	>	// ID RCURLY
2136		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_3(_tokenSet_3_data_,4);
2137	<	const unsigned long MDParser::_tokenSet_4_data_[] = { 134414080UL, 0UL, 0UL, 0UL };
2137	>	const unsigned long MDParser::_tokenSet_4_data_[] = { 196352UL, 8192UL, 0UL, 0UL };
2138		// "atom" "bond" "bend" "torsion" "inversion" "rigidBody" "cutoffGroup"
2139		// "constraint" "fragment" ID
2140		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_4(_tokenSet_4_data_,4);
2141	<	const unsigned long MDParser::_tokenSet_5_data_[] = { 536870912UL, 0UL, 0UL, 0UL };
2141	>	const unsigned long MDParser::_tokenSet_5_data_[] = { 0UL, 32768UL, 0UL, 0UL };
2142		// SEMICOLON
2143		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_5(_tokenSet_5_data_,4);
2144	<	const unsigned long MDParser::_tokenSet_6_data_[] = { 536870912UL, 52UL, 0UL, 0UL };
2144	>	const unsigned long MDParser::_tokenSet_6_data_[] = { 0UL, 13664256UL, 0UL, 0UL };
2145		// SEMICOLON RBRACKET RPAREN COMMA
2146		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_6(_tokenSet_6_data_,4);
2147	<	const unsigned long MDParser::_tokenSet_7_data_[] = { 536870912UL, 48UL, 0UL, 0UL };
2147	>	const unsigned long MDParser::_tokenSet_7_data_[] = { 0UL, 12615680UL, 0UL, 0UL };
2148		// SEMICOLON RPAREN COMMA
2149		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_7(_tokenSet_7_data_,4);
2150	<	const unsigned long MDParser::_tokenSet_8_data_[] = { 134414080UL, 1UL, 0UL, 0UL };
2150	>	const unsigned long MDParser::_tokenSet_8_data_[] = { 196352UL, 270336UL, 0UL, 0UL };
2151		// "atom" "bond" "bend" "torsion" "inversion" "rigidBody" "cutoffGroup"
2152		// "constraint" "fragment" ID RCURLY
2153		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_8(_tokenSet_8_data_,4);
2154	<	const unsigned long MDParser::_tokenSet_9_data_[] = { 140509184UL, 0UL, 0UL, 0UL };
2155	<	// "position" "orientation" ID
2154	>	const unsigned long MDParser::_tokenSet_9_data_[] = { 6291456UL, 10240UL, 0UL, 0UL };
2155	>	// "position" "orientation" "charge" ID
2156		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_9(_tokenSet_9_data_,4);
2157	<	const unsigned long MDParser::_tokenSet_10_data_[] = { 135790592UL, 0UL, 0UL, 0UL };
2158	<	// "center" "satellites" ID
2157	>	const unsigned long MDParser::_tokenSet_10_data_[] = { 4228120576UL, 8192UL, 0UL, 0UL };
2158	>	// "members" "Fixed" "Harmonic" "Cubic" "Quartic" "Polynomial" "Morse"
2159	>	// ID
2160		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_10(_tokenSet_10_data_,4);
2161	<	const unsigned long MDParser::_tokenSet_11_data_[] = { 140509184UL, 1UL, 0UL, 0UL };
2162	<	// "position" "orientation" ID RCURLY
2161	>	const unsigned long MDParser::_tokenSet_11_data_[] = { 2013528064UL, 8199UL, 0UL, 0UL };
2162	>	// "members" "Harmonic" "Cubic" "Quartic" "Polynomial" "GhostBend" "UreyBradley"
2163	>	// "Cosine" ID
2164		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_11(_tokenSet_11_data_,4);
2165	<	const unsigned long MDParser::_tokenSet_12_data_[] = { 0UL, 16UL, 0UL, 0UL };
2166	<	// RPAREN
2165	>	const unsigned long MDParser::_tokenSet_12_data_[] = { 2013528064UL, 8312UL, 0UL, 0UL };
2166	>	// "members" "Harmonic" "Cubic" "Quartic" "Polynomial" "GhostTorsion" "Charmm"
2167	>	// "Opls" "Trappe" ID
2168		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_12(_tokenSet_12_data_,4);
2169	<	const unsigned long MDParser::_tokenSet_13_data_[] = { 134479872UL, 1UL, 0UL, 0UL };
2170	<	// "members" ID RCURLY
2169	>	const unsigned long MDParser::_tokenSet_13_data_[] = { 135790592UL, 10112UL, 0UL, 0UL };
2170	>	// "center" "satellites" "Harmonic" "AmberImproper" "ImproperCosine" "CentralAtomHeight"
2171	>	// "Dreiding" ID
2172		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_13(_tokenSet_13_data_,4);
2173	<	const unsigned long MDParser::_tokenSet_14_data_[] = { 135790592UL, 1UL, 0UL, 0UL };
2174	<	// "center" "satellites" ID RCURLY
2173	>	const unsigned long MDParser::_tokenSet_14_data_[] = { 6291456UL, 272384UL, 0UL, 0UL };
2174	>	// "position" "orientation" "charge" ID RCURLY
2175		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_14(_tokenSet_14_data_,4);
2176	<	const unsigned long MDParser::_tokenSet_15_data_[] = { 134217728UL, 1UL, 0UL, 0UL };
2177	<	// ID RCURLY
2176	>	const unsigned long MDParser::_tokenSet_15_data_[] = { 0UL, 4194304UL, 0UL, 0UL };
2177	>	// RPAREN
2178		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_15(_tokenSet_15_data_,4);
2179	<	const unsigned long MDParser::_tokenSet_16_data_[] = { 0UL, 48UL, 0UL, 0UL };
2180	<	// RPAREN COMMA
2179	>	const unsigned long MDParser::_tokenSet_16_data_[] = { 4228120576UL, 270336UL, 0UL, 0UL };
2180	>	// "members" "Fixed" "Harmonic" "Cubic" "Quartic" "Polynomial" "Morse"
2181	>	// ID RCURLY
2182		const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_16(_tokenSet_16_data_,4);
2183	+	const unsigned long MDParser::_tokenSet_17_data_[] = { 2013528064UL, 270343UL, 0UL, 0UL };
2184	+	// "members" "Harmonic" "Cubic" "Quartic" "Polynomial" "GhostBend" "UreyBradley"
2185	+	// "Cosine" ID RCURLY
2186	+	const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_17(_tokenSet_17_data_,4);
2187	+	const unsigned long MDParser::_tokenSet_18_data_[] = { 2013528064UL, 270456UL, 0UL, 0UL };
2188	+	// "members" "Harmonic" "Cubic" "Quartic" "Polynomial" "GhostTorsion" "Charmm"
2189	+	// "Opls" "Trappe" ID RCURLY
2190	+	const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_18(_tokenSet_18_data_,4);
2191	+	const unsigned long MDParser::_tokenSet_19_data_[] = { 135790592UL, 272256UL, 0UL, 0UL };
2192	+	// "center" "satellites" "Harmonic" "AmberImproper" "ImproperCosine" "CentralAtomHeight"
2193	+	// "Dreiding" ID RCURLY
2194	+	const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_19(_tokenSet_19_data_,4);
2195	+	const unsigned long MDParser::_tokenSet_20_data_[] = { 262144UL, 270336UL, 0UL, 0UL };
2196	+	// "members" ID RCURLY
2197	+	const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_20(_tokenSet_20_data_,4);
2198	+	const unsigned long MDParser::_tokenSet_21_data_[] = { 0UL, 270336UL, 0UL, 0UL };
2199	+	// ID RCURLY
2200	+	const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_21(_tokenSet_21_data_,4);
2201	+	const unsigned long MDParser::_tokenSet_22_data_[] = { 0UL, 12582912UL, 0UL, 0UL };
2202	+	// RPAREN COMMA
2203	+	const ANTLR_USE_NAMESPACE(antlr)BitSet MDParser::_tokenSet_22(_tokenSet_22_data_,4);
2204
2205

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Comparing trunk/src/mdParser/MDParser.cpp (file contents): Revision 1979 by gezelter, Sat Apr 5 20:56:01 2014 UTC vs. Revision 2046 by gezelter, Tue Dec 2 22:11:04 2014 UTC

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Comparing trunk/src/mdParser/MDParser.cpp (file contents):
Revision 1979 by gezelter, Sat Apr 5 20:56:01 2014 UTC vs.
Revision 2046 by gezelter, Tue Dec 2 22:11:04 2014 UTC