#include #include #include "general.h" #include "vertex.h" #include "cell.h" #include "vesicle.h" #include "frame.h" char plugin_name[] = "Constant volume"; char plugin_description[]= "Plugin that enables constant volume of the vesicle."; char plugin_author[] = "SAMO PENIC"; typedef struct { ts_double dvol; ts_double V0; ts_double epsvol; } plugin_data; ts_plugin_details *init (){ ts_plugin_details *details=(ts_plugin_details *)calloc(1,sizeof(ts_plugin_details)); details->name = plugin_name; details->data = (plugin_data *)calloc(1,sizeof(plugin_data)); //storing data return details; } ts_vesicle *after_vesicle_init(ts_vesicle *vesicle){ plugin_data *data=(plugin_data *)vesicle->plist->pointer->plugin->details->data; ts_fprintf(stdout,"constant volume initialized\n"); centermass(vesicle); cell_occupation(vesicle); vesicle_volume(vesicle); //needed for constant volume at this moment data->V0=vesicle->volume; data->epsvol=4.0*sqrt(2.0*M_PI)/pow(3.0,3.0/4.0)*data->V0/pow(vesicle->tlist->n,3.0/2.0); return vesicle; } void vm_energy_before_prepare(ts_vesicle *vesicle, ts_vertex *vtx){ if(vesicle->tape->constvolswitch>0){ plugin_data *data=(plugin_data *)vesicle->plist->pointer->plugin->details->data; data->dvol=0; ts_uint i; for(i=0;itristar_no;i++) data->dvol-=vtx->tristar[i]->volume; } } ts_double vm_before_montecarlo_constraint(ts_vesicle *vesicle, ts_vertex *vtx, ts_vertex *old_vtx){ if(vesicle->tape->constvolswitch >0){ plugin_data *data=(plugin_data *)vesicle->plist->pointer->plugin->details->data; ts_uint i; for(i=0;itristar_no;i++) data->dvol+=vtx->tristar[i]->volume; if(fabs(vesicle->volume+data->dvol-data->V0)>data->epsvol) return TS_FAIL; } return TS_SUCCESS; } void vm_new_state_accepted(ts_vesicle *vesicle, ts_vertex *vtx, ts_vertex *old_vtx){ if(vesicle->tape->constvolswitch >0){ plugin_data *data=(plugin_data *)vesicle->plist->pointer->plugin->details->data; vesicle->volume+=data->dvol; } }