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mdrunoptions.h File Reference
#include "gromacs/utility/basedefinitions.h"
#include "gromacs/utility/real.h"
+ Include dependency graph for mdrunoptions.h:
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This file declares helper functionality for legacy option handling for mdrun.

It is likely that much of this content will move closer to the functionality that supports the respective features. For example, modules that change behaviour according to whether it is a rerun could register themselves with the rerun module and get notified at setup time to set their own boolean, rather than rely on a central glob of mdrun options being passed around.


struct  gmx::CheckpointOptions
 Options for writing checkpoint files. More...
struct  gmx::TimingOptions
 Options for timing (parts of) mdrun. More...
struct  gmx::ImdOptions
 Options for IMD. More...
struct  gmx::MdrunOptions
 Collection of all options of mdrun that are not processed separately. More...


enum  gmx::AppendingBehavior { gmx::AppendingBehavior::Auto, gmx::AppendingBehavior::Appending, gmx::AppendingBehavior::NoAppending }
 Enumeration for mdrun appending behavior. More...