| | |
| | | ts_uint tstep,n; |
| | | ts_char *number; |
| | | struct dirent **list; |
| | | ts_double l1,l2,l3; |
| | | ts_double l1,l2,l3,hbar; |
| | | int count; |
| | | ts_fprintf(stderr,"TRISURF-NG v. %s, compiled on: %s %s.\n", TS_VERSION, __DATE__, __TIME__); |
| | | |
| | | fprintf(stdout, "OuterLoop Volume Area lamdba1 lambda2 lambda3 Nbw/Nb\n"); |
| | | fprintf(stdout, "OuterLoop Volume Area lamdba1 lambda2 lambda3 Nbw/Nb hbar\n"); |
| | | |
| | | |
| | | count=scandir(".",&list,0,alphasort); |
| | |
| | | vesicle_volume(vesicle); |
| | | vesicle_area(vesicle); |
| | | gyration_eigen(vesicle,&l1,&l2,&l3); |
| | | fprintf(stdout,"%d %.17e %.17e %.17e %.17e %.17e %.17e\n",atoi(number),vesicle->volume, vesicle->area,l1,l2,l3, (ts_double)count_bonds_with_energy(vesicle->blist)/(ts_double)vesicle->blist->n), |
| | | hbar=vesicle_meancurvature(vesicle)/vesicle->area; |
| | | fprintf(stdout,"%d %.17e %.17e %.17e %.17e %.17e %.17e %.17e\n",atoi(number),vesicle->volume, vesicle->area,l1,l2,l3, (ts_double)count_bonds_with_energy(vesicle->blist)/(ts_double)vesicle->blist->n,hbar); |
| | | tstep++; |
| | | write_histogram_data(atoi(number), vesicle); |
| | | free(number); |