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#include <stdio.h> |
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#include <stdlib.h> |
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#include <string.h> |
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#include "interface.h" |
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#include "../headers/BASS_interface.h" |
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#ifdef IS_MPI |
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#include "../headers/mpiInterface.h" |
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#endif |
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void interface_error( event* the_event ); |
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the_event->evt.blk_index = comp_index; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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the_event->evt.blk_index = mol_index; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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the_event->evt.blk_index = atom_index; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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the_event->evt.blk_index = bond_index; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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the_event->evt.blk_index = bend_index; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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the_event->evt.blk_index = torsion_index; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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the_event->evt.mbr.d = the_node->the_data.mbr.d; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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the_event->evt.cnstr = the_node->the_data.cnstr.constraint_val; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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} |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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the_event->evt.pos.z = the_node->the_data.pos.z; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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the_event->evt.ornt.z = the_node->the_data.ort.z; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |
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void init_start_index( struct node_tag* the_node, |
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struct namespc the_namespc ){ |
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event* the_event; |
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int* si_array; |
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int n_elements = 0; |
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int index = 0; |
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struct integer_list_tag* head; |
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struct integer_list_tag* current; |
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the_event = (event* )malloc( sizeof( event ) ); |
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the_event->event_type = ORIENTATION; |
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the_event->err_msg = NULL; |
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head = the_node->the_data.il_head; |
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n_elements++; |
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current = head->next; |
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while( current != NULL ){ |
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n_elements++; |
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current = current->next; |
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} |
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the_event->evt.si.n_elements = n_elements; |
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si_array = ( int* ) calloc( n_elements, sizeof( int ) ); |
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si_array[index] = head->the_int; |
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current = head->next; |
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while( current != NULL ){ |
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index++; |
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si_array[index] = current->the_int; |
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current = current->next; |
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} |
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the_event->evt.si.array = si_array; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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free( the_event ); |
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} |
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void end_of_block( void ){ |
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event* the_event; |
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the_event->err_msg = NULL; |
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if( !event_handler( the_event ) ) interface_error( the_event ); |
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#ifdef IS_MPI |
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throwMPIEvent(the_event); |
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#endif |
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free( the_event ); |
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} |