Gromacs
2025-dev-20241008-cf8b9ef
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#include <gromacs/trajectoryanalysis/analysissettings_impl.h>
Private implementation class for TrajectoryAnalysisSettings.
Public Member Functions | |
Impl () | |
Initializes the default values for the settings object. | |
Public Attributes | |
TimeUnit | timeUnit |
Global time unit setting for the analysis module. | |
AnalysisDataPlotSettings | plotSettings |
Global plotting settings for the analysis module. | |
unsigned long | flags |
Flags for the analysis module. | |
int | frflags |
Frame reading flags for the analysis module. | |
bool | bRmPBC |
Whether to make molecules whole for each frame. | |
bool | bPBC |
Whether to pass PBC information to the analysis module. | |
ICommandLineOptionsModuleSettings * | optionsModuleSettings_ |
Lower-level settings object wrapped by these settings. | |