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41 #include "gromacs/legacyheaders/types/oenv.h"
42 #include "gromacs/legacyheaders/types/simple.h"
47 #if 0 /* avoid screwing up indentation */
52 /* output_env member functions */
54 /* The output_env structure holds information about program name, cmd line,
57 There are still legacy functions for the program name, and the command
58 line, but the output_env versions are now preferred.*/
62 timeNULL
, time_fs
, time_ps
, time_ns
, time_us
, time_ms
, time_s
64 /* the time units. For the time being, ps means no conversion. */
67 exvgNULL
, exvgXMGRACE
, exvgXMGR
, exvgNONE
69 /* the xvg output formattings */
72 void output_env_init_default(output_env_t
*oenvp
);
73 /* initialize an output_env structure, with reasonable default settings.
74 (the time unit is set to time_ps, which means no conversion). */
76 void output_env_done(output_env_t oenv
);
77 /* free memory allocated for an output_env structure. */
80 int output_env_get_verbosity(const output_env_t oenv
);
81 /* return the verbosity */
83 const char *output_env_get_time_unit(const output_env_t oenv
);
84 /* return time unit (e.g. ps or ns) */
86 const char *output_env_get_time_label(const output_env_t oenv
);
87 /* return time unit label (e.g. "Time (ps)") */
89 const char *output_env_get_xvgr_tlabel(const output_env_t oenv
);
90 /* retrun x-axis time label for xmgr */
92 real
output_env_get_time_factor(const output_env_t oenv
);
93 /* return time conversion factor from ps (i.e. 1e-3 for ps->ns) */
95 real
output_env_get_time_invfactor(const output_env_t oenv
);
96 /* return inverse time conversion factor to ps (i.e. 1e3 for ns->ps) */
98 real
output_env_conv_time(const output_env_t oenv
, real time
);
99 /* return converted time */
101 void output_env_conv_times(const output_env_t oenv
, int n
, real
*time
);
102 /* convert array of times */
104 gmx_bool
output_env_get_view(const output_env_t oenv
);
105 /* Return TRUE when user requested viewing of the file */
107 xvg_format_t
output_env_get_xvg_format(const output_env_t oenv
);
108 /* Returns enum (see above) for xvg output formatting */
111 * Returns display name for the currently running program.
113 const char *output_env_get_program_display_name(const output_env_t oenv
);
120 class IProgramContext
;
123 void output_env_init(output_env_t
*oenvp
,
124 const gmx::IProgramContext
&context
,
125 time_unit_t tmu
, gmx_bool view
, xvg_format_t xvg_format
,
127 /* initialize an output_env structure, setting the command line,
128 the default time value a gmx_boolean view that is set to TRUE when the
129 user requests direct viewing of graphs,
130 the graph formatting type, the verbosity, and debug level */
133 * Returns gmx::IProgramContext from an output_env structure.
135 const gmx::IProgramContext
&
136 output_env_get_program_context(const output_env_t oenv
);