| 1 | #include <stdio.h> | 
| 2 | #include <stdlib.h> | 
| 3 | #include <string.h> | 
| 4 |  | 
| 5 | #include "io/parse_interface.h" | 
| 6 | #include "io/BASS_interface.h" | 
| 7 | #include "utils/simError.h" | 
| 8 | #ifdef IS_MPI | 
| 9 | #include "io/mpiBASS.h" | 
| 10 | #endif | 
| 11 |  | 
| 12 | void interface_error( event* the_event ); | 
| 13 |  | 
| 14 | void init_component( int comp_index ){ | 
| 15 | event* the_event; | 
| 16 |  | 
| 17 | the_event = (event* )malloc( sizeof( event ) ); | 
| 18 |  | 
| 19 | the_event->event_type = COMPONENT; | 
| 20 | the_event->err_msg = NULL; | 
| 21 | the_event->evt.blk_index = comp_index; | 
| 22 |  | 
| 23 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 24 | #ifdef IS_MPI | 
| 25 | throwMPIEvent(the_event); | 
| 26 | #endif | 
| 27 |  | 
| 28 | free( the_event ); | 
| 29 | } | 
| 30 |  | 
| 31 | void init_molecule( int mol_index ){ | 
| 32 | event* the_event; | 
| 33 |  | 
| 34 | the_event = (event* )malloc( sizeof( event ) ); | 
| 35 |  | 
| 36 | the_event->event_type = MOLECULE; | 
| 37 | the_event->err_msg = NULL; | 
| 38 | the_event->evt.blk_index = mol_index; | 
| 39 |  | 
| 40 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 41 | #ifdef IS_MPI | 
| 42 | throwMPIEvent(the_event); | 
| 43 | #endif | 
| 44 |  | 
| 45 | free( the_event ); | 
| 46 | } | 
| 47 |  | 
| 48 | void init_rigidbody( int rigidbody_index ){ | 
| 49 | event* the_event; | 
| 50 |  | 
| 51 | the_event = (event* )malloc( sizeof( event ) ); | 
| 52 |  | 
| 53 | the_event->event_type = RIGIDBODY; | 
| 54 | the_event->err_msg = NULL; | 
| 55 | the_event->evt.blk_index = rigidbody_index; | 
| 56 |  | 
| 57 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 58 | #ifdef IS_MPI | 
| 59 | throwMPIEvent(the_event); | 
| 60 | #endif | 
| 61 |  | 
| 62 | free( the_event ); | 
| 63 | } | 
| 64 |  | 
| 65 | void init_cutoffgroup( int cutoffgroup_index ){ | 
| 66 | event* the_event; | 
| 67 |  | 
| 68 | the_event = (event* )malloc( sizeof( event ) ); | 
| 69 |  | 
| 70 | the_event->event_type = CUTOFFGROUP; | 
| 71 | the_event->err_msg = NULL; | 
| 72 | the_event->evt.blk_index = cutoffgroup_index; | 
| 73 |  | 
| 74 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 75 | #ifdef IS_MPI | 
| 76 | throwMPIEvent(the_event); | 
| 77 | #endif | 
| 78 |  | 
| 79 | free( the_event ); | 
| 80 | } | 
| 81 |  | 
| 82 | void init_atom( int atom_index ){ | 
| 83 | event* the_event; | 
| 84 |  | 
| 85 | the_event = (event* )malloc( sizeof( event ) ); | 
| 86 |  | 
| 87 | the_event->event_type = ATOM; | 
| 88 | the_event->err_msg = NULL; | 
| 89 | the_event->evt.blk_index = atom_index; | 
| 90 |  | 
| 91 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 92 | #ifdef IS_MPI | 
| 93 | throwMPIEvent(the_event); | 
| 94 | #endif | 
| 95 |  | 
| 96 | free( the_event ); | 
| 97 | } | 
| 98 |  | 
| 99 | void init_bond( int bond_index ){ | 
| 100 | event* the_event; | 
| 101 |  | 
| 102 | the_event = (event* )malloc( sizeof( event ) ); | 
| 103 |  | 
| 104 | the_event->event_type = BOND; | 
| 105 | the_event->err_msg = NULL; | 
| 106 | the_event->evt.blk_index = bond_index; | 
| 107 |  | 
| 108 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 109 | #ifdef IS_MPI | 
| 110 | throwMPIEvent(the_event); | 
| 111 | #endif | 
| 112 |  | 
| 113 | free( the_event ); | 
| 114 | } | 
| 115 |  | 
| 116 | void init_bend( int bend_index ){ | 
| 117 | event* the_event; | 
| 118 |  | 
| 119 | the_event = (event* )malloc( sizeof( event ) ); | 
| 120 |  | 
| 121 | the_event->event_type = BEND; | 
| 122 | the_event->err_msg = NULL; | 
| 123 | the_event->evt.blk_index = bend_index; | 
| 124 |  | 
| 125 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 126 | #ifdef IS_MPI | 
| 127 | throwMPIEvent(the_event); | 
| 128 | #endif | 
| 129 |  | 
| 130 | free( the_event ); | 
| 131 | } | 
| 132 |  | 
| 133 | void init_torsion( int torsion_index ){ | 
| 134 | event* the_event; | 
| 135 |  | 
| 136 | the_event = (event* )malloc( sizeof( event ) ); | 
| 137 |  | 
| 138 | the_event->event_type = TORSION; | 
| 139 | the_event->err_msg = NULL; | 
| 140 | the_event->evt.blk_index = torsion_index; | 
| 141 |  | 
| 142 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 143 | #ifdef IS_MPI | 
| 144 | throwMPIEvent(the_event); | 
| 145 | #endif | 
| 146 |  | 
| 147 | free( the_event ); | 
| 148 | } | 
| 149 |  | 
| 150 | void init_zconstraint( int zconstraint_index ){ | 
| 151 | event* the_event; | 
| 152 |  | 
| 153 | the_event = (event* )malloc( sizeof( event ) ); | 
| 154 |  | 
| 155 | the_event->event_type = ZCONSTRAINT; | 
| 156 | the_event->err_msg = NULL; | 
| 157 | the_event->evt.blk_index = zconstraint_index; | 
| 158 |  | 
| 159 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 160 | #ifdef IS_MPI | 
| 161 | throwMPIEvent(the_event); | 
| 162 | #endif | 
| 163 |  | 
| 164 | free( the_event ); | 
| 165 | } | 
| 166 |  | 
| 167 |  | 
| 168 | /* | 
| 169 | * the next few deal with the statement initializations | 
| 170 | */ | 
| 171 |  | 
| 172 | void init_members( struct node_tag* the_node, | 
| 173 | struct namespc the_namespc ){ | 
| 174 | event* the_event; | 
| 175 | int i; | 
| 176 |  | 
| 177 | the_event = (event* )malloc( sizeof( event ) ); | 
| 178 |  | 
| 179 | the_event->event_type = MEMBERS; | 
| 180 | the_event->err_msg = NULL; | 
| 181 |  | 
| 182 | the_event->evt.mbrs.nMembers = the_node->the_data.mbrs.nMembers; | 
| 183 |  | 
| 184 | the_event->evt.mbrs.memberList = (int *) calloc(the_node->the_data.mbrs.nMembers, | 
| 185 | sizeof(int)); | 
| 186 |  | 
| 187 | for (i = 0; i < the_node->the_data.mbrs.nMembers; i++) { | 
| 188 | the_event->evt.mbrs.memberList[i] = the_node->the_data.mbrs.memberList[i]; | 
| 189 | } | 
| 190 |  | 
| 191 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 192 | #ifdef IS_MPI | 
| 193 | throwMPIEvent(the_event); | 
| 194 | #endif | 
| 195 |  | 
| 196 | free( the_event->evt.mbrs.memberList ); | 
| 197 | free( the_event ); | 
| 198 | } | 
| 199 |  | 
| 200 | void init_constraint( struct node_tag* the_node, | 
| 201 | struct namespc the_namespc ){ | 
| 202 | event* the_event; | 
| 203 |  | 
| 204 | the_event = (event* )malloc( sizeof( event ) ); | 
| 205 |  | 
| 206 | the_event->event_type = CONSTRAINT; | 
| 207 | the_event->err_msg = NULL; | 
| 208 | the_event->evt.cnstr = the_node->the_data.cnstr.constraint_val; | 
| 209 |  | 
| 210 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 211 | #ifdef IS_MPI | 
| 212 | throwMPIEvent(the_event); | 
| 213 | #endif | 
| 214 |  | 
| 215 | free( the_event ); | 
| 216 | } | 
| 217 |  | 
| 218 | void init_assignment( struct node_tag* the_node, | 
| 219 | struct namespc the_namespc ){ | 
| 220 | event* the_event; | 
| 221 |  | 
| 222 | the_event = (event* )malloc( sizeof( event ) ); | 
| 223 |  | 
| 224 | the_event->event_type = ASSIGNMENT; | 
| 225 | the_event->err_msg = NULL; | 
| 226 |  | 
| 227 | strcpy( the_event->evt.asmt.lhs, the_node->the_data.asmt.identifier ); | 
| 228 | switch( the_node->the_data.asmt.type ){ | 
| 229 |  | 
| 230 | case STR_ASSN: | 
| 231 | the_event->evt.asmt.asmt_type = STRING; | 
| 232 | strcpy( the_event->evt.asmt.rhs.sval, | 
| 233 | the_node->the_data.asmt.rhs.str_ptr ); | 
| 234 | break; | 
| 235 |  | 
| 236 | case INT_ASSN: | 
| 237 | the_event->evt.asmt.asmt_type = INT; | 
| 238 | the_event->evt.asmt.rhs.ival = the_node->the_data.asmt.rhs.i_val; | 
| 239 | break; | 
| 240 |  | 
| 241 | case DOUBLE_ASSN: | 
| 242 | the_event->evt.asmt.asmt_type = DOUBLE; | 
| 243 | the_event->evt.asmt.rhs.dval = the_node->the_data.asmt.rhs.d_val; | 
| 244 | break; | 
| 245 | } | 
| 246 |  | 
| 247 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 248 | #ifdef IS_MPI | 
| 249 | throwMPIEvent(the_event); | 
| 250 | #endif | 
| 251 |  | 
| 252 | free( the_event ); | 
| 253 | } | 
| 254 |  | 
| 255 | void init_position( struct node_tag* the_node, | 
| 256 | struct namespc the_namespc ){ | 
| 257 | event* the_event; | 
| 258 |  | 
| 259 | the_event = (event* )malloc( sizeof( event ) ); | 
| 260 |  | 
| 261 | the_event->event_type = POSITION; | 
| 262 | the_event->err_msg = NULL; | 
| 263 | the_event->evt.pos.x = the_node->the_data.pos.x; | 
| 264 | the_event->evt.pos.y = the_node->the_data.pos.y; | 
| 265 | the_event->evt.pos.z = the_node->the_data.pos.z; | 
| 266 |  | 
| 267 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 268 | #ifdef IS_MPI | 
| 269 | throwMPIEvent(the_event); | 
| 270 | #endif | 
| 271 |  | 
| 272 | free( the_event ); | 
| 273 | } | 
| 274 |  | 
| 275 | void init_orientation( struct node_tag* the_node, | 
| 276 | struct namespc the_namespc ){ | 
| 277 | event* the_event; | 
| 278 |  | 
| 279 | the_event = (event* )malloc( sizeof( event ) ); | 
| 280 |  | 
| 281 | the_event->event_type = ORIENTATION; | 
| 282 | the_event->err_msg = NULL; | 
| 283 | the_event->evt.ornt.phi   = the_node->the_data.ort.phi; | 
| 284 | the_event->evt.ornt.theta = the_node->the_data.ort.theta; | 
| 285 | the_event->evt.ornt.psi   = the_node->the_data.ort.psi; | 
| 286 |  | 
| 287 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 288 | #ifdef IS_MPI | 
| 289 | throwMPIEvent(the_event); | 
| 290 | #endif | 
| 291 |  | 
| 292 | free( the_event ); | 
| 293 | } | 
| 294 |  | 
| 295 |  | 
| 296 | void end_of_block( void ){ | 
| 297 | event* the_event; | 
| 298 |  | 
| 299 | the_event = (event* )malloc( sizeof( event ) ); | 
| 300 |  | 
| 301 | the_event->event_type = BLOCK_END; | 
| 302 | the_event->err_msg = NULL; | 
| 303 |  | 
| 304 | if( !event_handler( the_event ) ) interface_error( the_event ); | 
| 305 | #ifdef IS_MPI | 
| 306 | throwMPIEvent(the_event); | 
| 307 | #endif | 
| 308 |  | 
| 309 | free( the_event ); | 
| 310 | } | 
| 311 |  | 
| 312 | void interface_error( event* the_event ){ | 
| 313 |  | 
| 314 | sprintf( painCave.errMsg, | 
| 315 | "Error in parsing meta-data file!\n" | 
| 316 | "\t%s\n", | 
| 317 | the_event->err_msg ); | 
| 318 | painCave.severity = OOPSE_ERROR; | 
| 319 | painCave.isFatal = 1; | 
| 320 | simError(); | 
| 321 | #ifdef IS_MPI | 
| 322 | mpiInterfaceExit(); | 
| 323 | #endif //IS_MPI | 
| 324 | } |