43 |
|
ORIENTATION = "orientation"; |
44 |
|
FLUCQ = "flucQ"; |
45 |
|
RNEMD = "RNEMD"; |
46 |
+ |
MINIMIZER = "minimizer"; |
47 |
|
ENDBLOCK; |
48 |
|
} |
49 |
|
|
58 |
|
| restraintblock |
59 |
|
| flucqblock |
60 |
|
| rnemdblock |
61 |
+ |
| minimizerblock |
62 |
|
; |
63 |
|
|
64 |
|
assignment : ID ASSIGNEQUAL^ constant SEMICOLON! |
84 |
|
|
85 |
|
rnemdblock : RNEMD^ LCURLY! (assignment)* RCURLY {#RCURLY->setType(ENDBLOCK);} |
86 |
|
; |
87 |
+ |
|
88 |
+ |
minimizerblock : MINIMIZER^ LCURLY! (assignment)* RCURLY {#RCURLY->setType(ENDBLOCK);} |
89 |
+ |
; |
90 |
|
|
91 |
|
moleculeblock : MOLECULE^ LCURLY! (moleculestatement)* RCURLY {#RCURLY->setType(ENDBLOCK);} |
92 |
|
; |