36
36
extern struct sysenv_pak sysenv;
37
37
extern struct elem_pak elements[];
41
void write_pdb_core(FILE *fp, gint i, struct core_pak *core, struct model_pak *model)
60
i, core->atom_label, res_name, chain, core->res_no,
61
x[0], x[1], x[2], core->sof, 0.0, "", elements[core->atom_code].symbol, "");
42
68
gint write_pdb(gchar *filename, struct model_pak *model)
48
73
struct core_pak *core, *core2;