/usr/include/gromacs/options/timeunitmanager.h is in libgromacs-dev 2016.1-2.
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* This file is part of the GROMACS molecular simulation package.
*
* Copyright (c) 2012,2014,2015, by the GROMACS development team, led by
* Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
* and including many others, as listed in the AUTHORS file in the
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/*! \file
* \brief
* Declares gmx::TimeUnitManager.
*
* \author Teemu Murtola <teemu.murtola@gmail.com>
* \inpublicapi
* \ingroup module_options
*/
#ifndef GMX_OPTIONS_TIMEUNITMANAGER_H
#define GMX_OPTIONS_TIMEUNITMANAGER_H
#include "gromacs/options/ioptionsbehavior.h"
#include "gromacs/utility/classhelpers.h"
#include "gromacs/utility/gmxassert.h"
namespace gmx
{
class IOptionsContainer;
class Options;
/*! \brief
* Time values for TimeUnitManager.
*
* \if internal
* Currently, this should match with the time_unit_t enum defined in oenv.h
* except that there is no NULL first item in this enum.
* \endif
*
* \inpublicapi
*/
enum TimeUnit
{
TimeUnit_fs, //!< Femtoseconds.
TimeUnit_ps, //!< Picoseconds.
TimeUnit_ns, //!< Nanoseconds.
TimeUnit_us, //!< Microseconds.
TimeUnit_ms, //!< Milliseconds.
TimeUnit_s, //!< Seconds.
TimeUnit_Default = TimeUnit_ps //!< Default time unit.
};
/*! \brief
* Provides common functionality for time unit conversions.
*
* Methods/objects that need to deal with time units can either take a
* TimeUnitManager object, or they can take a TimeUnit value and construct a
* TimeUnitManager object internally.
*
* Default copy constructor and assignment are used: the copy is an independent
* object that is initialized with the same time unit as the original.
*
* \if internal
* \todo
* This class is independent of the options implementation.
* To ease reuse, it could be moved to the utility module, and only
* TimeUnitBehavior left here.
* \endif
*
* \inpublicapi
* \ingroup module_options
*/
class TimeUnitManager
{
public:
//! Creates a time unit manager with the default (ps) time unit.
TimeUnitManager();
//! Creates a time unit manager with the given time unit.
explicit TimeUnitManager(TimeUnit unit);
//! Returns the currently selected time unit.
TimeUnit timeUnit() const
{
GMX_ASSERT(timeUnit_ >= 0 && timeUnit_ <= TimeUnit_s,
"Time unit index has become out-of-range");
return timeUnit_;
}
//! Set a new time unit for the manager.
void setTimeUnit(TimeUnit unit);
//! Returns a string constant corresponding to the current time unit.
const char *timeUnitAsString() const;
//! Returns the scaling factor to convert times to ps.
double timeScaleFactor() const;
//! Returns the scaling factor to convert times from ps.
double inverseTimeScaleFactor() const;
private:
//! Currently set time unit for this manager.
TimeUnit timeUnit_;
};
/*! \brief
* Options behavior to add a time unit option.
*
* This class provides functionality to add a time unit option that affects the
* input unit for time options (specified with FloatOption::timeValue() or
* DoubleOption::timeValue()). When options are finished, it scales each time
* option such that any user-given values are interpreted as given in the time
* unit specified by the user, and scaled to picoseconds. Programmatically
* given values (e.g., as default values for the options) are not scaled.
*
* \inpublicapi
* \ingroup module_options
*/
class TimeUnitBehavior : public IOptionsBehavior
{
public:
TimeUnitBehavior();
//! Returns the current time unit.
TimeUnit timeUnit() const
{
GMX_ASSERT(timeUnit_ >= 0 && timeUnit_ <= TimeUnit_s,
"Time unit index has become out-of-range");
return static_cast<TimeUnit>(timeUnit_);
}
//! Sets the time unit.
void setTimeUnit(TimeUnit unit);
/*! \brief
* Sets a storage location for the selected time unit.
*
* \param[in] store Location that will receive the selected time unit.
*
* \p *store will be set to the time unit selected by the user (or
* programmatically). The value is guaranteed to be set once the
* options have been finished.
*/
void setTimeUnitStore(TimeUnit *store);
/*! \brief
* Sets the default time unit from an environment variable.
*
* This should be called before addTimeUnitOption() for consistent
* behavior.
*/
void setTimeUnitFromEnvironment();
/*! \brief
* Adds a common option for selecting the time unit.
*
* \param[in,out] options Options to which the common option is added.
* \param[in] name Name of the option to add.
*
* Adds an enum option to \p options to select the time unit for this
* behavior.
*/
void addTimeUnitOption(IOptionsContainer *options, const char *name);
// From IOptionsBehavior
virtual void initBehavior(Options * /*options*/) {}
virtual void optionsFinishing(Options *options);
virtual void optionsFinished() {}
private:
TimeUnit timeUnit_;
TimeUnit *timeUnitStore_;
GMX_DISALLOW_COPY_AND_ASSIGN(TimeUnitBehavior);
};
} // namespace gmx
#endif
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