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; |
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; |
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; |
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; |
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; |
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; |
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; |
724 |
|
tmp37_AST = astFactory->create(LT(1)); |
725 |
|
astFactory->addASTChild(currentAST, tmp37_AST); |
726 |
|
match(RCURLY); |
727 |
< |
#line 110 "MDParser.g" |
727 |
> |
#line 128 "MDParser.g" |
728 |
|
tmp37_AST->setType(ENDBLOCK); |
729 |
|
#line 730 "MDParser.cpp" |
730 |
|
atomblock_AST = currentAST.root; |
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 |
|
} |
783 |
|
tmp42_AST = astFactory->create(LT(1)); |
784 |
|
astFactory->addASTChild(currentAST, tmp42_AST); |
785 |
|
match(RCURLY); |
786 |
< |
#line 119 "MDParser.g" |
786 |
> |
#line 138 "MDParser.g" |
787 |
|
tmp42_AST->setType(ENDBLOCK); |
788 |
|
#line 789 "MDParser.cpp" |
789 |
|
bondblock_AST = currentAST.root; |
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 |
|
} |
842 |
|
tmp47_AST = astFactory->create(LT(1)); |
843 |
|
astFactory->addASTChild(currentAST, tmp47_AST); |
844 |
|
match(RCURLY); |
845 |
< |
#line 126 "MDParser.g" |
845 |
> |
#line 151 "MDParser.g" |
846 |
|
tmp47_AST->setType(ENDBLOCK); |
847 |
|
#line 848 "MDParser.cpp" |
848 |
|
bendblock_AST = currentAST.root; |
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 |
|
} |
901 |
|
tmp52_AST = astFactory->create(LT(1)); |
902 |
|
astFactory->addASTChild(currentAST, tmp52_AST); |
903 |
|
match(RCURLY); |
904 |
< |
#line 133 "MDParser.g" |
904 |
> |
#line 165 "MDParser.g" |
905 |
|
tmp52_AST->setType(ENDBLOCK); |
906 |
|
#line 907 "MDParser.cpp" |
907 |
|
torsionblock_AST = currentAST.root; |
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 |
|
} |
960 |
|
tmp57_AST = astFactory->create(LT(1)); |
961 |
|
astFactory->addASTChild(currentAST, tmp57_AST); |
962 |
|
match(RCURLY); |
963 |
< |
#line 140 "MDParser.g" |
963 |
> |
#line 180 "MDParser.g" |
964 |
|
tmp57_AST->setType(ENDBLOCK); |
965 |
|
#line 966 "MDParser.cpp" |
966 |
|
inversionblock_AST = currentAST.root; |
1004 |
|
tmp62_AST = astFactory->create(LT(1)); |
1005 |
|
astFactory->addASTChild(currentAST, tmp62_AST); |
1006 |
|
match(RCURLY); |
1007 |
< |
#line 148 "MDParser.g" |
1007 |
> |
#line 193 "MDParser.g" |
1008 |
|
tmp62_AST->setType(ENDBLOCK); |
1009 |
|
#line 1010 "MDParser.cpp" |
1010 |
|
rigidbodyblock_AST = currentAST.root; |
1063 |
|
tmp67_AST = astFactory->create(LT(1)); |
1064 |
|
astFactory->addASTChild(currentAST, tmp67_AST); |
1065 |
|
match(RCURLY); |
1066 |
< |
#line 155 "MDParser.g" |
1066 |
> |
#line 200 "MDParser.g" |
1067 |
|
tmp67_AST->setType(ENDBLOCK); |
1068 |
|
#line 1069 "MDParser.cpp" |
1069 |
|
cutoffgroupblock_AST = currentAST.root; |
1107 |
|
tmp72_AST = astFactory->create(LT(1)); |
1108 |
|
astFactory->addASTChild(currentAST, tmp72_AST); |
1109 |
|
match(RCURLY); |
1110 |
< |
#line 162 "MDParser.g" |
1110 |
> |
#line 207 "MDParser.g" |
1111 |
|
tmp72_AST->setType(ENDBLOCK); |
1112 |
|
#line 1113 "MDParser.cpp" |
1113 |
|
fragmentblock_AST = currentAST.root; |
1166 |
|
tmp77_AST = astFactory->create(LT(1)); |
1167 |
|
astFactory->addASTChild(currentAST, tmp77_AST); |
1168 |
|
match(RCURLY); |
1169 |
< |
#line 168 "MDParser.g" |
1169 |
> |
#line 213 "MDParser.g" |
1170 |
|
tmp77_AST->setType(ENDBLOCK); |
1171 |
|
#line 1172 "MDParser.cpp" |
1172 |
|
constraintblock_AST = currentAST.root; |
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()); |
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 |
|
} |
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 |
|
} |
1294 |
|
} |
1295 |
|
case MEMBERS: |
1296 |
|
{ |
1297 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp87_AST = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1298 |
< |
tmp87_AST = astFactory->create(LT(1)); |
1299 |
< |
astFactory->makeASTRoot(currentAST, tmp87_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()); |
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 |
|
} |
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 |
|
} |
1450 |
|
} |
1451 |
|
case MEMBERS: |
1452 |
|
{ |
1453 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp92_AST = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1454 |
< |
tmp92_AST = astFactory->create(LT(1)); |
1455 |
< |
astFactory->makeASTRoot(currentAST, tmp92_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(); |
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()); |
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 |
|
} |
1589 |
|
} |
1590 |
|
case MEMBERS: |
1591 |
|
{ |
1592 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp96_AST = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1593 |
< |
tmp96_AST = astFactory->create(LT(1)); |
1594 |
< |
astFactory->makeASTRoot(currentAST, tmp96_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(); |
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()); |
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 |
|
} |
1742 |
|
} |
1743 |
|
case CENTER: |
1744 |
|
{ |
1745 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp100_AST = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1746 |
< |
tmp100_AST = astFactory->create(LT(1)); |
1747 |
< |
astFactory->makeASTRoot(currentAST, tmp100_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(); |
1756 |
|
} |
1757 |
|
case SATELLITES: |
1758 |
|
{ |
1759 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp104_AST = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1760 |
< |
tmp104_AST = astFactory->create(LT(1)); |
1761 |
< |
astFactory->makeASTRoot(currentAST, tmp104_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(); |
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()); |
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 |
|
} |
1867 |
|
} |
1868 |
|
case MEMBERS: |
1869 |
|
{ |
1870 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp108_AST = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1871 |
< |
tmp108_AST = astFactory->create(LT(1)); |
1872 |
< |
astFactory->makeASTRoot(currentAST, tmp108_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(); |
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 |
|
} |
1908 |
|
} |
1909 |
|
case MEMBERS: |
1910 |
|
{ |
1911 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp112_AST = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1912 |
< |
tmp112_AST = astFactory->create(LT(1)); |
1913 |
< |
astFactory->makeASTRoot(currentAST, tmp112_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(); |
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 |
|
} |
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 |
|
} |
1966 |
|
} |
1967 |
|
case MEMBERS: |
1968 |
|
{ |
1969 |
< |
ANTLR_USE_NAMESPACE(antlr)RefAST tmp116_AST = ANTLR_USE_NAMESPACE(antlr)nullAST; |
1970 |
< |
tmp116_AST = astFactory->create(LT(1)); |
1971 |
< |
astFactory->makeASTRoot(currentAST, tmp116_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(); |
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 |
|
} |
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>", |
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", |
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 |
|
|