79 |
|
} |
80 |
|
|
81 |
|
/* |
82 |
< |
The next three functions deal with creating and initializing of the |
83 |
< |
members statements used by the bonds, bends, and torsions. |
82 |
> |
The next function deals with creating and initializing of the |
83 |
> |
members statements used by the bonds, bends, torsions, and rigid bodies. |
84 |
|
*/ |
85 |
|
|
86 |
< |
struct node_tag* members_2( int a, int b ){ |
86 |
> |
struct node_tag* members( char* list_str ){ |
87 |
|
|
88 |
|
struct node_tag* the_node; |
89 |
|
the_node = ( struct node_tag* )malloc( sizeof( node ) ); |
90 |
|
|
91 |
< |
the_node->type = MEMBER_STMT; |
91 |
> |
the_node->type = MEMBERS_STMT; |
92 |
|
the_node->index = 0; |
93 |
|
the_node->next_stmt = NULL; |
94 |
|
the_node->prev_stmt = NULL; |
95 |
|
the_node->stmt_list = NULL; |
96 |
|
|
97 |
< |
the_node->the_data.mbr.a = a; |
98 |
< |
the_node->the_data.mbr.b = b; |
99 |
< |
the_node->the_data.mbr.c = 0; |
100 |
< |
the_node->the_data.mbr.d = 0; |
97 |
> |
int nTokens, i; |
98 |
> |
char *foo; |
99 |
|
|
100 |
< |
return the_node; |
103 |
< |
} |
100 |
> |
nTokens = count_tokens(list_str, " ,;\t"); |
101 |
|
|
102 |
< |
struct node_tag* members_3( int a, int b, int c ){ |
102 |
> |
if (nTokens < 1) { |
103 |
> |
yyerror("can't find any members in this members statement"); |
104 |
> |
} |
105 |
|
|
106 |
< |
struct node_tag* the_node; |
108 |
< |
the_node = ( struct node_tag* )malloc( sizeof( node ) ); |
109 |
< |
|
110 |
< |
the_node->type = MEMBER_STMT; |
111 |
< |
the_node->index = 0; |
112 |
< |
the_node->next_stmt = NULL; |
113 |
< |
the_node->prev_stmt = NULL; |
114 |
< |
the_node->stmt_list = NULL; |
115 |
< |
|
116 |
< |
the_node->the_data.mbr.a = a; |
117 |
< |
the_node->the_data.mbr.b = b; |
118 |
< |
the_node->the_data.mbr.c = c; |
119 |
< |
the_node->the_data.mbr.d = 0; |
106 |
> |
the_node->the_data.mbrs.nMembers = nTokens; |
107 |
|
|
108 |
< |
return the_node; |
122 |
< |
} |
108 |
> |
the_node->the_data.mbrs.memberList = (int *) calloc(nTokens, sizeof(int)); |
109 |
|
|
110 |
< |
struct node_tag* members_4( int a, int b, int c, int d ){ |
110 |
> |
foo = strtok(list_str, " ,;\t"); |
111 |
> |
the_node->the_data.mbrs.memberList[0] = atoi( foo ); |
112 |
|
|
113 |
< |
struct node_tag* the_node; |
114 |
< |
the_node = ( struct node_tag* )malloc( sizeof( node ) ); |
115 |
< |
|
116 |
< |
the_node->type = MEMBER_STMT; |
130 |
< |
the_node->index = 0; |
131 |
< |
the_node->next_stmt = NULL; |
132 |
< |
the_node->prev_stmt = NULL; |
133 |
< |
the_node->stmt_list = NULL; |
134 |
< |
|
135 |
< |
the_node->the_data.mbr.a = a; |
136 |
< |
the_node->the_data.mbr.b = b; |
137 |
< |
the_node->the_data.mbr.c = c; |
138 |
< |
the_node->the_data.mbr.d = d; |
113 |
> |
for (i = 1; i < nTokens; i++) { |
114 |
> |
foo = strtok(NULL, " ,;\t"); |
115 |
> |
the_node->the_data.mbrs.memberList[i] = atoi( foo ); |
116 |
> |
} |
117 |
|
|
118 |
|
return the_node; |
119 |
|
} |
122 |
|
This function does the C & I of the constraint statements |
123 |
|
*/ |
124 |
|
|
125 |
< |
struct node_tag* constraint( double constraint_val ){ |
125 |
> |
struct node_tag* constraint( char* list_str ){ |
126 |
|
|
127 |
|
struct node_tag* the_node; |
128 |
|
the_node = ( struct node_tag* )malloc( sizeof( node ) ); |
133 |
|
the_node->prev_stmt = NULL; |
134 |
|
the_node->stmt_list = NULL; |
135 |
|
|
136 |
< |
the_node->the_data.cnstr.constraint_val = constraint_val; |
136 |
> |
int nTokens; |
137 |
> |
char *foo; |
138 |
|
|
139 |
+ |
nTokens = count_tokens(list_str, " ,;\t"); |
140 |
+ |
if (nTokens != 1) { |
141 |
+ |
yyerror("wrong number of arguments given in constraint statement"); |
142 |
+ |
} |
143 |
+ |
|
144 |
+ |
foo = strtok(list_str, " ,;\t"); |
145 |
+ |
the_node->the_data.cnstr.constraint_val = atof( foo ); |
146 |
+ |
|
147 |
|
return the_node; |
148 |
|
} |
149 |
|
|
151 |
|
This function does the C & I for the orientation statements |
152 |
|
*/ |
153 |
|
|
154 |
< |
struct node_tag* orientation( double x, double y, double z ){ |
154 |
> |
struct node_tag* orientation( char* list_str ){ |
155 |
|
|
156 |
|
struct node_tag* the_node; |
157 |
|
the_node = ( struct node_tag* )malloc( sizeof( node ) ); |
161 |
|
the_node->next_stmt = NULL; |
162 |
|
the_node->prev_stmt = NULL; |
163 |
|
the_node->stmt_list = NULL; |
164 |
< |
|
165 |
< |
the_node->the_data.pos.x = x; |
166 |
< |
the_node->the_data.pos.y = y; |
167 |
< |
the_node->the_data.pos.z = z; |
168 |
< |
|
164 |
> |
|
165 |
> |
int nTokens; |
166 |
> |
char *foo; |
167 |
> |
|
168 |
> |
nTokens = count_tokens(list_str, " ,;\t"); |
169 |
> |
if (nTokens != 3) { |
170 |
> |
yyerror("wrong number of arguments given in orientation"); |
171 |
> |
} |
172 |
> |
|
173 |
> |
foo = strtok(list_str, " ,;\t"); |
174 |
> |
the_node->the_data.ort.phi = atof( foo ); |
175 |
> |
|
176 |
> |
foo = strtok(NULL, " ,;\t"); |
177 |
> |
the_node->the_data.ort.theta = atof( foo ); |
178 |
> |
|
179 |
> |
foo = strtok(NULL, " ,;\t"); |
180 |
> |
the_node->the_data.ort.psi = atof( foo ); |
181 |
> |
|
182 |
|
return the_node; |
183 |
|
} |
184 |
|
|
186 |
|
This function does the C & I for the position statements |
187 |
|
*/ |
188 |
|
|
189 |
< |
struct node_tag* position( double x, double y, double z ){ |
189 |
> |
struct node_tag* position( char* list_str ){ |
190 |
|
|
191 |
|
struct node_tag* the_node; |
192 |
|
the_node = ( struct node_tag* )malloc( sizeof( node ) ); |
196 |
|
the_node->next_stmt = NULL; |
197 |
|
the_node->prev_stmt = NULL; |
198 |
|
the_node->stmt_list = NULL; |
199 |
+ |
|
200 |
+ |
int nTokens; |
201 |
+ |
char *foo; |
202 |
+ |
|
203 |
+ |
nTokens = count_tokens(list_str, " ,;\t"); |
204 |
+ |
if (nTokens != 3) { |
205 |
+ |
yyerror("wrong number of arguments given in position"); |
206 |
+ |
} |
207 |
+ |
|
208 |
+ |
foo = strtok(list_str, " ,;\t"); |
209 |
+ |
the_node->the_data.pos.x = atof( foo ); |
210 |
+ |
|
211 |
+ |
foo = strtok(NULL, " ,;\t"); |
212 |
+ |
the_node->the_data.pos.y = atof( foo ); |
213 |
+ |
|
214 |
+ |
foo = strtok(NULL, " ,;\t"); |
215 |
+ |
the_node->the_data.pos.z = atof( foo ); |
216 |
+ |
|
217 |
|
|
200 |
– |
the_node->the_data.pos.x = x; |
201 |
– |
the_node->the_data.pos.y = y; |
202 |
– |
the_node->the_data.pos.z = z; |
203 |
– |
|
218 |
|
return the_node; |
219 |
|
} |
220 |
|
|
334 |
|
|
335 |
|
return the_node; |
336 |
|
} |
337 |
+ |
|
338 |
+ |
|
339 |
+ |
int count_tokens(char *line, char *delimiters) { |
340 |
+ |
/* PURPOSE: RETURN A COUNT OF THE NUMBER OF TOKENS ON THE LINE. */ |
341 |
+ |
|
342 |
+ |
char *working_line; /* WORKING COPY OF LINE. */ |
343 |
+ |
int ntokens; /* NUMBER OF TOKENS FOUND IN LINE. */ |
344 |
+ |
char *strtok_ptr; /* POINTER FOR STRTOK. */ |
345 |
+ |
|
346 |
+ |
strtok_ptr= working_line= strdup(line); |
347 |
+ |
|
348 |
+ |
ntokens=0; |
349 |
+ |
while (strtok(strtok_ptr,delimiters)!=NULL) |
350 |
+ |
{ |
351 |
+ |
ntokens++; |
352 |
+ |
strtok_ptr=NULL; |
353 |
+ |
} |
354 |
+ |
|
355 |
+ |
free(working_line); |
356 |
+ |
return(ntokens); |
357 |
+ |
} |