Preference variable declarations.
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| typedef struct bond_cutoff | bond_cutoff |
| | bond cutoff data structure
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| typedef struct element_radius | element_radius |
| | element radius data structure
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| typedef struct element_color | element_color |
| | element color data structure
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| typedef struct rep_data | rep_data |
| | representation data structure
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| float | get_radius (int object, int col, int z, element_radius *rad_list) |
| | retrieve the radius/width of a species depending on style
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| ColRGBA | get_spec_color (int z, element_color *clist) |
| | retrieve the color of a chemical species
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| GtkWidget * | adv_box (GtkWidget *box, char *lab, int vspace, int size, float xalign) |
| | create a box with markup label
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| void | duplicate_background_data (background *new_back, background *old_back) |
| | duplicate background data structure
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| void | duplicate_box_data (box *new_box, box *old_box) |
| | duplicate box_data data structure
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| void | duplicate_axis_data (axis *new_axis, axis *old_axis) |
| | duplicate axis_data data structure
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| void | set_atomes_preferences () |
| | set software default parameters
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◆ bond_cutoff
| typedef struct bond_cutoff bond_cutoff |
◆ element_color
| typedef struct element_color element_color |
◆ element_radius
| typedef struct element_radius element_radius |
◆ rep_data
| typedef struct rep_data rep_data |
◆ adv_box()
| GtkWidget * adv_box |
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GtkWidget * | box, |
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char * | lab, |
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int | vspace, |
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int | size, |
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float | xalign ) |
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extern |
create a box with markup label
- Parameters
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| box | the box to insert the widget in |
| lab | label |
| vspace | vertical space |
| size | size |
| xalign | x alignement |
Definition at line 146 of file w_advance.c.
◆ duplicate_axis_data()
| void duplicate_axis_data |
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axis * | new_axis, |
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axis * | old_axis ) |
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extern |
duplicate axis_data data structure
- Parameters
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| new_axis | the new axis_data structure |
| old_axis | the axis_data structure to copy |
Definition at line 4544 of file preferences.c.
◆ duplicate_background_data()
duplicate background data structure
- Parameters
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| new_back | the new background structure |
| old_back | the background structure to copy |
Definition at line 4507 of file preferences.c.
◆ duplicate_box_data()
| void duplicate_box_data |
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box * | new_box, |
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box * | old_box ) |
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extern |
duplicate box_data data structure
- Parameters
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| new_box | the new box structure |
| old_box | the box structure to copy |
Definition at line 4528 of file preferences.c.
◆ get_radius()
| float get_radius |
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int | object, |
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int | col, |
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int | z, |
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element_radius * | rad_list ) |
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extern |
retrieve the radius/width of a species depending on style
- Parameters
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| object | the object to look at |
| col | modifier for tabulated radii |
| z | atomic number |
| rad_list | pre allocated data, if any |
Definition at line 2673 of file preferences.c.
◆ get_spec_color()
retrieve the color of a chemical species
- Parameters
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| z | atomic number |
| clist | the target color list, if any |
Definition at line 2765 of file preferences.c.
◆ set_atomes_preferences()
| void set_atomes_preferences |
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| ) |
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extern |
◆ default_acl_format
| int default_acl_format[2] |
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extern |
◆ default_at_rs
◆ default_atom_color
◆ default_atomic_rad
◆ default_axis
◆ default_background
◆ default_bd_rw
◆ default_bond_cutoff
◆ default_bond_rad
◆ default_box
◆ default_chain_param
| gchar* default_chain_param[7] |
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extern |
◆ default_clones
◆ default_csparam
Chain statistics parameters:
0 = Initial node(s) for the search: selected chemical species or all atoms,
1 = Maximum size for a chain Cmax,
2 = Maximum number of chain(s) per MD step CNUMA,
3 = Search only for AAAA chains or not,
4 = Search only for ABAB chains or not,
5 = Include Homopolar bond(s) in the analysis or not,
6 = Search only for 1-(2)n-1 chains
Definition at line 210 of file preferences.c.
◆ default_delta_t
0 = time step,
1 = time unit , in: fs, ps, ns, µs, ms
Definition at line 195 of file preferences.c.
◆ default_fog
◆ default_label
◆ default_label_color
◆ default_lightning
◆ default_material
◆ default_mfactor
◆ default_mpattern
◆ default_mtilt
| gboolean default_mtilt[2] |
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extern |
◆ default_mwidth
◆ default_num_delta
Number of x points:
0 = gr,
1 = sq,
2 = sk,
3 = gftt,
4 = bd,
5 = an,
6 = sp
7 = msd
8 = S(q,w)
Definition at line 191 of file preferences.c.
◆ default_o_at_rs
| gboolean* default_o_at_rs |
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extern |
◆ default_o_bd_rw
| gboolean* default_o_bd_rw |
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extern |
◆ default_opengl
◆ default_rep
◆ default_ring_param
| gchar* default_ring_param[7] |
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extern |
◆ default_rsparam
Ring statistics parameters:
0 = Default search,
1 = Initial node(s) for the search: selected chemical species or all atoms,
2 = Maximum size of ring for the search Rmax,
3 = Maximum number of ring(s) per MD step NUMA,
4 = Search only for ABAB rings or not,
5 = Include Homopolar bond(s) in the analysis or not,
6 = Include homopolar bond(s) when calculating the distance matrix
Definition at line 199 of file preferences.c.
◆ default_sel_color
◆ default_skt_n_sets
Number of configuration(s) to save when computing S(k,t)
Definition at line 222 of file preferences.c.
◆ default_skt_sets
| gboolean default_skt_sets |
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extern |
Output calculation results for all t steps
Definition at line 221 of file preferences.c.
◆ default_sqw_freq
◆ default_sqw_n_sets
Number of q vector(s) to compute S(q,w)
Definition at line 223 of file preferences.c.
◆ default_totcut
◆ pref_axis_win
◆ pref_box_win
◆ pref_gradient_win
◆ pref_ogl_edit
◆ pref_pointer
◆ pref_rep_win
◆ preferences
◆ tmp_acl_format
◆ tmp_atomic_rad
◆ tmp_axis
◆ tmp_background
◆ tmp_bond_cutoff
◆ tmp_bond_rad
◆ tmp_box
◆ tmp_csparam
◆ tmp_delta_t
◆ tmp_fog
◆ tmp_label
◆ tmp_lightning
◆ tmp_material
◆ tmp_mfactor
◆ tmp_mpattern
◆ tmp_mtilt
◆ tmp_mwidth
◆ tmp_num_delta
◆ tmp_opengl
◆ tmp_rep
◆ tmp_rsparam
◆ tmp_skt_n_sets
◆ tmp_skt_sets
◆ tmp_sqw_freq
◆ tmp_sqw_n_sets
◆ tmp_totcut
1.16.1