| | |
| | | #include "initial_distribution.h" |
| | | #include "poly.h" |
| | | |
| | | |
| | | |
| | | /** DUMP STATE TO DISK DRIVE **/ |
| | | |
| | | ts_bool dump_state(ts_vesicle *vesicle){ |
| | | |
| | | /* save current state with wrong pointers. Will fix that later */ |
| | | ts_uint i,j,k; |
| | | FILE *fh=fopen("dump.bin","wb"); |
| | | |
| | | /* dump vesicle */ |
| | | fwrite(vesicle, sizeof(ts_vesicle),1,fh); |
| | | /* dump vertex list */ |
| | | fwrite(vesicle->vlist, sizeof(ts_vertex_list),1,fh); |
| | | /* dump bond list */ |
| | | fwrite(vesicle->blist, sizeof(ts_bond_list),1,fh); |
| | | /* dump triangle list */ |
| | | fwrite(vesicle->tlist, sizeof(ts_triangle_list),1,fh); |
| | | /* dump cell list */ |
| | | fwrite(vesicle->clist, sizeof(ts_cell_list),1,fh); |
| | | /* dump poly list */ |
| | | fwrite(vesicle->poly_list, sizeof(ts_poly_list),1,fh); |
| | | /* level 1 complete */ |
| | | |
| | | /*dump vertices*/ |
| | | for(i=0;i<vesicle->vlist->n;i++){ |
| | | fwrite(vesicle->vlist->vtx[i],sizeof(ts_vertex),1,fh); |
| | | /* dump pointer offsets for: |
| | | neigh |
| | | bond |
| | | tria |
| | | cell is ignored |
| | | */ |
| | | for(j=0;j<vesicle->vlist->vtx[i]->neigh_no;j++){ |
| | | fwrite(&vesicle->vlist->vtx[i]->neigh[j]->idx,sizeof(ts_uint),1,fh); |
| | | } |
| | | for(j=0;j<vesicle->vlist->vtx[i]->bond_no;j++){ |
| | | fwrite(&vesicle->vlist->vtx[i]->bond[j]->idx,sizeof(ts_uint),1,fh); |
| | | } |
| | | for(j=0;j<vesicle->vlist->vtx[i]->tristar_no;j++){ |
| | | fwrite(&vesicle->vlist->vtx[i]->tristar[j]->idx,sizeof(ts_uint),1,fh); |
| | | } |
| | | } |
| | | |
| | | /*dump bonds*/ |
| | | for(i=0;i<vesicle->blist->n;i++){ |
| | | fwrite(vesicle->blist->bond[i],sizeof(ts_bond),1,fh); |
| | | /* dump pointer offsets for vtx1 and vtx2 */ |
| | | //off=(ts_ulong)(vesicle->blist->bond[i]->vtx1-vesicle->vlist->vtx[0]); |
| | | fwrite(&vesicle->blist->bond[i]->vtx1->idx,sizeof(ts_uint),1,fh); |
| | | //off=(ts_ulong)(vesicle->blist->bond[i]->vtx2-vesicle->vlist->vtx[0]); |
| | | fwrite(&vesicle->blist->bond[i]->vtx2->idx,sizeof(ts_uint),1,fh); |
| | | } |
| | | |
| | | /*dump triangles*/ |
| | | for(i=0;i<vesicle->tlist->n;i++){ |
| | | fwrite(vesicle->tlist->tria[i],sizeof(ts_triangle),1,fh); |
| | | /* dump pointer offsets for vertex */ |
| | | fwrite(&vesicle->tlist->tria[i]->vertex[0]->idx,sizeof(ts_uint),1,fh); |
| | | fwrite(&vesicle->tlist->tria[i]->vertex[1]->idx,sizeof(ts_uint),1,fh); |
| | | fwrite(&vesicle->tlist->tria[i]->vertex[2]->idx,sizeof(ts_uint),1,fh); |
| | | /* dump pointer offsets for neigh */ |
| | | for(j=0;j<vesicle->tlist->tria[i]->neigh_no;j++){ |
| | | fwrite(&vesicle->tlist->tria[i]->neigh[j]->idx,sizeof(ts_uint),1,fh); |
| | | } |
| | | } |
| | | |
| | | |
| | | /*dump polymeres */ |
| | | for(i=0;i<vesicle->poly_list->n;i++){ |
| | | fwrite(vesicle->poly_list->poly[i],sizeof(ts_poly),1,fh); |
| | | fwrite(vesicle->poly_list->poly[i]->vlist,sizeof(ts_vertex_list),1,fh); |
| | | fwrite(vesicle->poly_list->poly[i]->blist,sizeof(ts_bond_list),1,fh); |
| | | } |
| | | |
| | | /* dump poly vertex(monomer) list*/ |
| | | for(i=0;i<vesicle->poly_list->n;i++){ |
| | | for(j=0;j<vesicle->poly_list->poly[i]->vlist->n;j++){ |
| | | fwrite(vesicle->poly_list->poly[i]->vlist->vtx[j],sizeof(ts_vertex),1,fh); |
| | | /* dump offset for neigh and bond */ |
| | | for(k=0;k<vesicle->poly_list->poly[i]->vlist->vtx[j]->neigh_no;k++){ |
| | | // off=(ts_ulong)(vesicle->poly_list->poly[i]->vlist->vtx[j]->neigh[k]-vesicle->poly_list->poly[i]->vlist->vtx[0]); |
| | | fwrite(&vesicle->poly_list->poly[i]->vlist->vtx[j]->neigh[k]->idx,sizeof(ts_uint),1,fh); |
| | | } |
| | | for(k=0;k<vesicle->poly_list->poly[i]->vlist->vtx[j]->bond_no;k++){ |
| | | //off=(ts_ulong)(vesicle->poly_list->poly[i]->vlist->vtx[j]->bond[k]-vesicle->poly_list->poly[i]->blist->bond[0]); |
| | | fwrite(&vesicle->poly_list->poly[i]->vlist->vtx[j]->bond[k]->idx,sizeof(ts_uint),1,fh); |
| | | } |
| | | } |
| | | // grafted vtx on vesicle data dump |
| | | fwrite(&vesicle->poly_list->poly[i]->grafted_vtx->idx, sizeof(ts_uint),1,fh); |
| | | } |
| | | /* dump poly bonds between monomers list*/ |
| | | for(i=0;i<vesicle->poly_list->n;i++){ |
| | | for(j=0;j<vesicle->poly_list->poly[i]->blist->n;j++){ |
| | | fwrite(vesicle->poly_list->poly[i]->blist->bond[j],sizeof(ts_bond),1,fh); |
| | | /* dump vtx1 and vtx2 offsets */ |
| | | //off=(ts_ulong)(vesicle->poly_list->poly[i]->blist->bond[j]->vtx1-vesicle->poly_list->poly[i]->vlist->vtx[0]); |
| | | fwrite(&vesicle->poly_list->poly[i]->blist->bond[j]->vtx1->idx,sizeof(ts_uint),1,fh); |
| | | // off=(ts_ulong)(vesicle->poly_list->poly[i]->blist->bond[j]->vtx2-vesicle->poly_list->poly[i]->vlist->vtx[0]); |
| | | fwrite(&vesicle->poly_list->poly[i]->blist->bond[j]->vtx2->idx,sizeof(ts_uint),1,fh); |
| | | } |
| | | } |
| | | |
| | | /* pointer offsets for fixing the restored pointers */ |
| | | /* need pointers for |
| | | vlist->vtx |
| | | blist->bond |
| | | tlist->tria |
| | | clist->cell |
| | | poly_list->poly |
| | | and for each poly: |
| | | poly_list->poly->vtx |
| | | poly_list->poly->bond |
| | | */ |
| | | |
| | | fwrite(vesicle->clist, sizeof(ts_cell_list),1, fh); |
| | | |
| | | fclose(fh); |
| | | return TS_SUCCESS; |
| | | } |
| | | |
| | | |
| | | /** RESTORE DUMP FROM DISK **/ |
| | | ts_vesicle *restore_state(){ |
| | | ts_uint i,j,k; |
| | | FILE *fh=fopen("dump.bin","rb"); |
| | | ts_uint retval; |
| | | ts_uint idx; |
| | | |
| | | /* we restore all the data from the dump */ |
| | | /* restore vesicle */ |
| | | ts_vesicle *vesicle=(ts_vesicle *)calloc(1,sizeof(ts_vesicle)); |
| | | retval=fread(vesicle, sizeof(ts_vesicle),1,fh); |
| | | // fprintf(stderr,"was here! %e\n",vesicle->dmax); |
| | | |
| | | /* restore vertex list */ |
| | | vesicle->vlist=(ts_vertex_list *)malloc(sizeof(ts_vertex_list)); |
| | | retval=fread(vesicle->vlist, sizeof(ts_vertex_list),1,fh); |
| | | /* restore bond list */ |
| | | vesicle->blist=(ts_bond_list *)malloc(sizeof(ts_bond_list)); |
| | | retval=fread(vesicle->blist, sizeof(ts_bond_list),1,fh); |
| | | /* restore triangle list */ |
| | | vesicle->tlist=(ts_triangle_list *)malloc(sizeof(ts_triangle_list)); |
| | | retval=fread(vesicle->tlist, sizeof(ts_triangle_list),1,fh); |
| | | /* restore cell list */ |
| | | vesicle->clist=(ts_cell_list *)malloc(sizeof(ts_cell_list)); |
| | | retval=fread(vesicle->clist, sizeof(ts_cell_list),1,fh); |
| | | /* restore poly list */ |
| | | vesicle->poly_list=(ts_poly_list *)calloc(1,sizeof(ts_poly_list)); |
| | | retval=fread(vesicle->poly_list, sizeof(ts_poly_list),1,fh); |
| | | /* level 1 complete */ |
| | | |
| | | /* prerequisity. Bonds must be malloced before vertexes are recreated */ |
| | | vesicle->blist->bond=(ts_bond **)calloc(vesicle->blist->n,sizeof(ts_bond *)); |
| | | for(i=0;i<vesicle->blist->n;i++){ |
| | | vesicle->blist->bond[i]=(ts_bond *)malloc(sizeof(ts_bond)); |
| | | } |
| | | /* prerequisity. Triangles must be malloced before vertexes are recreated */ |
| | | vesicle->tlist->tria=(ts_triangle **)calloc(vesicle->tlist->n,sizeof(ts_triangle *)); |
| | | for(i=0;i<vesicle->tlist->n;i++){ |
| | | vesicle->tlist->tria[i]=(ts_triangle *)malloc(sizeof(ts_triangle)); |
| | | } |
| | | /* prerequisity. Vertices must be malloced before vertexes are recreated */ |
| | | vesicle->vlist->vtx=(ts_vertex **)calloc(vesicle->vlist->n,sizeof(ts_vertex *)); |
| | | for(i=0;i<vesicle->vlist->n;i++){ |
| | | vesicle->vlist->vtx[i]=(ts_vertex *)malloc(sizeof(ts_vertex)); |
| | | } |
| | | /*restore vertices*/ |
| | | for(i=0;i<vesicle->vlist->n;i++){ |
| | | retval=fread(vesicle->vlist->vtx[i],sizeof(ts_vertex),1,fh); |
| | | /*restore neigh, bond, tristar. Ignoring cell */ |
| | | vesicle->vlist->vtx[i]->neigh=(ts_vertex **)calloc(vesicle->vlist->vtx[i]->neigh_no, sizeof(ts_vertex *)); |
| | | for(j=0;j<vesicle->vlist->vtx[i]->neigh_no;j++){ |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->vlist->vtx[i]->neigh[j]=vesicle->vlist->vtx[idx]; |
| | | } |
| | | vesicle->vlist->vtx[i]->bond=(ts_bond **)calloc(vesicle->vlist->vtx[i]->bond_no, sizeof(ts_bond *)); |
| | | for(j=0;j<vesicle->vlist->vtx[i]->bond_no;j++){ |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | /* pointer can be assigned only when list of bonds is fully initialized in memory. Thus bondlist popularization must be done before vertex can reference to it */ |
| | | vesicle->vlist->vtx[i]->bond[j]=vesicle->blist->bond[idx]; |
| | | } |
| | | |
| | | vesicle->vlist->vtx[i]->tristar=(ts_triangle **)calloc(vesicle->vlist->vtx[i]->tristar_no, sizeof(ts_triangle *)); |
| | | for(j=0;j<vesicle->vlist->vtx[i]->tristar_no;j++){ |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | /* same comment as above */ |
| | | vesicle->vlist->vtx[i]->tristar[j]=vesicle->tlist->tria[idx]; |
| | | } |
| | | |
| | | } |
| | | |
| | | /*restore bonds*/ |
| | | // vesicle->blist->bond=(ts_bond **)calloc(vesicle->blist->n,sizeof(ts_bond *)); // done before. |
| | | for(i=0;i<vesicle->blist->n;i++){ |
| | | // vesicle->blist->bond[i]=(ts_bond *)malloc(sizeof(ts_bond)); //done before. |
| | | retval=fread(vesicle->blist->bond[i],sizeof(ts_bond),1,fh); |
| | | /* restore vtx1 and vtx2 */ |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->blist->bond[i]->vtx1=vesicle->vlist->vtx[idx]; |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->blist->bond[i]->vtx2=vesicle->vlist->vtx[idx]; |
| | | } |
| | | |
| | | /*restore triangles*/ |
| | | // vesicle->tlist->tria=(ts_triangle **)calloc(vesicle->tlist->n,sizeof(ts_triangle *)); // done before |
| | | for(i=0;i<vesicle->tlist->n;i++){ |
| | | // vesicle->tlist->tria[i]=(ts_triangle *)malloc(sizeof(ts_triangle)); // done before |
| | | retval=fread(vesicle->tlist->tria[i],sizeof(ts_triangle),1,fh); |
| | | /* restore pointers for vertices */ |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->tlist->tria[i]->vertex[0]=vesicle->vlist->vtx[idx]; |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->tlist->tria[i]->vertex[1]=vesicle->vlist->vtx[idx]; |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->tlist->tria[i]->vertex[2]=vesicle->vlist->vtx[idx]; |
| | | /* restore pointers for neigh */ |
| | | vesicle->tlist->tria[i]->neigh=(ts_triangle **)malloc(vesicle->tlist->tria[i]->neigh_no*sizeof(ts_triangle *)); |
| | | for(j=0;j<vesicle->tlist->tria[i]->neigh_no;j++){ |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->tlist->tria[i]->neigh[j]=vesicle->tlist->tria[idx]; |
| | | } |
| | | |
| | | } |
| | | |
| | | /*restore cells */ |
| | | /*TODO: do we need to recalculate cells here? */ |
| | | /* vesicle->clist->cell=(ts_cell **)malloc(vesicle->clist->cellno*sizeof(ts_cell *)); |
| | | for(i=0;i<vesicle->clist->cellno;i++){ |
| | | vesicle->clist->cell[i]=(ts_cell *)malloc(sizeof(ts_cell)); |
| | | retval=fread(vesicle->clist->cell[i],sizeof(ts_cell),1,fh); |
| | | } |
| | | */ |
| | | /*restore polymeres */ |
| | | vesicle->poly_list->poly = (ts_poly **)calloc(vesicle->poly_list->n,sizeof(ts_poly *)); |
| | | for(i=0;i<vesicle->poly_list->n;i++){ |
| | | vesicle->poly_list->poly[i]=(ts_poly *)calloc(1,sizeof(ts_poly)); |
| | | retval=fread(vesicle->poly_list->poly[i],sizeof(ts_poly),1,fh); |
| | | vesicle->poly_list->poly[i]->vlist=(ts_vertex_list *)calloc(1,sizeof(ts_vertex_list)); |
| | | retval=fread(vesicle->poly_list->poly[i]->vlist,sizeof(ts_vertex_list),1,fh); |
| | | vesicle->poly_list->poly[i]->blist=(ts_bond_list *)calloc(1,sizeof(ts_bond_list)); |
| | | retval=fread(vesicle->poly_list->poly[i]->blist,sizeof(ts_bond_list),1,fh); |
| | | /* initialize adress space for pointers that will hold specific vertices (monomers) and bonds */ |
| | | vesicle->poly_list->poly[i]->vlist->vtx=(ts_vertex **)calloc(vesicle->poly_list->poly[i]->vlist->n,sizeof(ts_vertex *)); |
| | | vesicle->poly_list->poly[i]->blist->bond=(ts_bond **)calloc(vesicle->poly_list->poly[i]->blist->n,sizeof(ts_bond *)); |
| | | for(j=0;j<vesicle->poly_list->poly[i]->vlist->n;j++){ |
| | | vesicle->poly_list->poly[i]->vlist->vtx[j]=(ts_vertex *)malloc(sizeof(ts_vertex)); |
| | | } |
| | | for(j=0;j<vesicle->poly_list->poly[i]->blist->n;j++){ |
| | | vesicle->poly_list->poly[i]->blist->bond[j]=(ts_bond *)malloc(sizeof(ts_bond)); |
| | | } |
| | | |
| | | } |
| | | |
| | | |
| | | /* restore poly vertex(monomer) list*/ |
| | | for(i=0;i<vesicle->poly_list->n;i++){ |
| | | for(j=0;j<vesicle->poly_list->poly[i]->vlist->n;j++){ |
| | | retval=fread(vesicle->poly_list->poly[i]->vlist->vtx[j],sizeof(ts_vertex),1,fh); |
| | | |
| | | /* restore neigh and bonds */ |
| | | vesicle->poly_list->poly[i]->vlist->vtx[j]->neigh=(ts_vertex **)calloc(vesicle->poly_list->poly[i]->vlist->vtx[j]->neigh_no, sizeof(ts_vertex *)); |
| | | for(k=0;k<vesicle->poly_list->poly[i]->vlist->vtx[j]->neigh_no;k++){ |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->poly_list->poly[i]->vlist->vtx[j]->neigh[k]=vesicle->poly_list->poly[i]->vlist->vtx[idx]; |
| | | } |
| | | vesicle->poly_list->poly[i]->vlist->vtx[j]->bond=(ts_bond **)calloc(vesicle->poly_list->poly[i]->vlist->vtx[j]->bond_no, sizeof(ts_bond *)); |
| | | for(k=0;k<vesicle->poly_list->poly[i]->vlist->vtx[j]->bond_no;k++){ |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->poly_list->poly[i]->vlist->vtx[j]->bond[k]=vesicle->poly_list->poly[i]->blist->bond[idx]; |
| | | } |
| | | |
| | | } |
| | | /* restore grafted vtx on vesicle and grafted_poly */ |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->vlist->vtx[idx]->grafted_poly=vesicle->poly_list->poly[i]; |
| | | vesicle->poly_list->poly[i]->grafted_vtx=vesicle->vlist->vtx[idx]; |
| | | } |
| | | |
| | | /* restore poly bonds between monomers list*/ |
| | | for(i=0;i<vesicle->poly_list->n;i++){ |
| | | for(j=0;j<vesicle->poly_list->poly[i]->blist->n;j++){ |
| | | // vesicle->poly_list->poly[i]->blist->bond[j]=(ts_bond *)malloc(sizeof(ts_bond)); |
| | | retval=fread(vesicle->poly_list->poly[i]->blist->bond[j],sizeof(ts_bond),1,fh); |
| | | /* restore vtx1 and vtx2 */ |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->poly_list->poly[i]->blist->bond[j]->vtx1=vesicle->poly_list->poly[i]->vlist->vtx[idx]; |
| | | retval=fread(&idx,sizeof(ts_uint),1,fh); |
| | | vesicle->poly_list->poly[i]->blist->bond[j]->vtx2=vesicle->poly_list->poly[i]->vlist->vtx[idx]; |
| | | } |
| | | } |
| | | |
| | | // recreating space for cells // |
| | | vesicle->clist=(ts_cell_list *)malloc(sizeof(ts_cell_list)); |
| | | retval=fread(vesicle->clist, sizeof(ts_cell_list), 1,fh); |
| | | vesicle->clist->cell=(ts_cell **)malloc(sizeof(ts_cell *)*vesicle->clist->ncmax[0]*vesicle->clist->ncmax[1]*vesicle->clist->ncmax[2]); |
| | | for(i=0;i<vesicle->clist->ncmax[0]*vesicle->clist->ncmax[1]*vesicle->clist->ncmax[2];i++){ |
| | | vesicle->clist->cell[i]=(ts_cell *)calloc(1,sizeof(ts_cell)); |
| | | vesicle->clist->cell[i]->idx=i+1; // We enumerate cells! Probably never required! |
| | | } |
| | | |
| | | if(retval); |
| | | fclose(fh); |
| | | return vesicle; |
| | | } |
| | | |
| | | |
| | | |
| | | ts_bool print_vertex_list(ts_vertex_list *vlist){ |
| | | ts_uint i; |
| | | printf("Number of vertices: %u\n",vlist->n); |
| | |
| | | /* Here comes header of the file */ |
| | | |
| | | //find number of extra vtxs and bonds of polymeres |
| | | ts_uint monono=0, polyno=0; |
| | | ts_uint monono=0, polyno=0, poly_idx=0; |
| | | ts_bool poly=0; |
| | | if(vesicle->poly_list!=NULL){ |
| | | if(vesicle->poly_list->poly[0]!=NULL){ |
| | |
| | | } |
| | | //polymeres |
| | | if(poly){ |
| | | poly_idx=vlist->n; |
| | | for(i=0;i<vesicle->poly_list->n;i++){ |
| | | for(j=0;j<vesicle->poly_list->poly[i]->vlist->n;j++){ |
| | | fprintf(fh,"%u ", vesicle->poly_list->poly[i]->vlist->vtx[j]->idx); |
| | | for(j=0;j<vesicle->poly_list->poly[i]->vlist->n;j++,poly_idx++){ |
| | | fprintf(fh,"%u ", poly_idx); |
| | | } |
| | | } |
| | | } |
| | |
| | | } |
| | | //polymeres |
| | | if(poly){ |
| | | poly_idx=vlist->n; |
| | | for(i=0;i<vesicle->poly_list->n;i++){ |
| | | for(j=0;j<vesicle->poly_list->poly[i]->blist->n;j++){ |
| | | fprintf(fh,"%u %u\n", vesicle->poly_list->poly[i]->blist->bond[j]->vtx1->idx,vesicle->poly_list->poly[i]->blist->bond[j]->vtx2->idx); |
| | | // fprintf(fh,"%u %u\n", vesicle->poly_list->poly[i]->blist->bond[j]->vtx1->idx,vesicle->poly_list->poly[i]->blist->bond[j]->vtx2->idx); |
| | | fprintf(fh,"%u %u\n", vesicle->poly_list->poly[i]->blist->bond[j]->vtx1->idx+vlist->n+i*monono,vesicle->poly_list->poly[i]->blist->bond[j]->vtx2->idx+vlist->n+i*monono); |
| | | } |
| | | //grafted bonds |
| | | fprintf(fh,"%u %u\n", vesicle->poly_list->poly[i]->grafted_vtx->idx, vesicle->poly_list->poly[i]->vlist->vtx[0]->idx); |
| | | fprintf(fh,"%u %u\n", vesicle->poly_list->poly[i]->grafted_vtx->idx, vesicle->poly_list->poly[i]->vlist->vtx[0]->idx+vlist->n+i*monono); |
| | | } |
| | | |
| | | } |