Gromacs
5.1
|
Represents copies of average histograms.
Methods in AbstractAverageHistogram that return new histogram instances return objects of this class. Initialization of values is handled in those methods.
Public Member Functions | |
StaticAverageHistogram (const AnalysisHistogramSettings &settings) | |
Creates an average histogram module with defined bin parameters. | |
Public Member Functions inherited from gmx::AbstractAverageHistogram | |
const AnalysisHistogramSettings & | settings () const |
Returns bin properties for the histogram. | |
AverageHistogramPointer | resampleDoubleBinWidth (bool bIntegerBins) const |
Creates a copy of the histogram with double the bin width. More... | |
AverageHistogramPointer | clone () const |
Creates a deep copy of the histogram. More... | |
void | normalizeProbability () |
Normalizes the histogram such that the integral over it is one. | |
void | makeCumulative () |
Makes the histograms cumulative by summing up each bin to all bins after it. More... | |
void | scaleSingle (int index, real factor) |
Scales a single histogram by a uniform scaling factor. | |
void | scaleAll (real factor) |
Scales all histograms by a uniform scaling factor. | |
void | scaleAllByVector (real factor[]) |
Scales the value of each bin by a different scaling factor. | |
void | done () |
Notifies attached modules of the histogram data. More... | |
Public Member Functions inherited from gmx::AbstractAnalysisArrayData | |
virtual int | frameCount () const |
Returns the total number of frames in the data. More... | |
int | rowCount () const |
Returns the number of rows in the data array. More... | |
bool | isAllocated () const |
Returns true if values have been allocated. | |
real | xstart () const |
Returns the x value of the first frame. | |
real | xstep () const |
Returns the step between frame x values. | |
real | xvalue (int row) const |
Returns the x value of a row. | |
const AnalysisDataValue & | value (int row, int col) const |
Returns a given array element. | |
Public Member Functions inherited from gmx::AbstractAnalysisData | |
bool | isMultipoint () const |
Whether the data can have multiple points in the same column in the same frame. More... | |
int | dataSetCount () const |
Returns the number of data sets in the data object. More... | |
int | columnCount (int dataSet) const |
Returns the number of columns in a data set. More... | |
int | columnCount () const |
Returns the number of columns in the data. More... | |
AnalysisDataFrameRef | tryGetDataFrame (int index) const |
Access stored data. More... | |
AnalysisDataFrameRef | getDataFrame (int index) const |
Access stored data. More... | |
bool | requestStorage (int nframes) |
Request storage of frames. More... | |
void | addModule (AnalysisDataModulePointer module) |
Adds a module to process the data. More... | |
void | addColumnModule (int col, int span, AnalysisDataModulePointer module) |
Adds a module that processes only a subset of the columns. More... | |
void | applyModule (AnalysisDataModuleInterface *module) |
Applies a module to process data that is ready. More... | |
Additional Inherited Members | |
Protected Member Functions inherited from gmx::AbstractAverageHistogram | |
AbstractAverageHistogram () | |
Creates a histogram module with undefined bins. More... | |
AbstractAverageHistogram (const AnalysisHistogramSettings &settings) | |
Creates a histogram module with defined bin parameters. | |
void | init (const AnalysisHistogramSettings &settings) |
(Re)initializes the histogram from settings. | |
Protected Member Functions inherited from gmx::AbstractAnalysisArrayData | |
AbstractAnalysisArrayData () | |
Initializes an empty array data object. More... | |
void | setColumnCount (int ncols) |
Sets the number of columns in the data array. More... | |
void | setRowCount (int rowCount) |
Sets the number of rows in the data array. More... | |
void | allocateValues () |
Allocates memory for the values. More... | |
void | setXAxis (real start, real step) |
Sets the values reported as x values for frames. More... | |
void | setXAxisValue (int row, real value) |
Sets a single value reported as x value for frames. More... | |
AnalysisDataValue & | value (int row, int col) |
Returns a reference to a given array element. | |
void | valuesReady () |
Notifies modules of the data. More... | |
Protected Member Functions inherited from gmx::AbstractAnalysisData | |
AbstractAnalysisData () | |
Initializes a new analysis data object. More... | |
void | setDataSetCount (int dataSetCount) |
Sets the number of data sets. More... | |
void | setColumnCount (int dataSet, int columnCount) |
Sets the number of columns for a data set. More... | |
void | setMultipoint (bool bMultipoint) |
Sets whether the data has multiple points per column in a frame. More... | |
AnalysisDataModuleManager & | moduleManager () |
Returns the module manager to use for calling notification methods. | |
const AnalysisDataModuleManager & | moduleManager () const |
Returns the module manager to use for calling notification methods. | |
Static Protected Member Functions inherited from gmx::AbstractAnalysisArrayData | |
static void | copyContents (const AbstractAnalysisArrayData *src, AbstractAnalysisArrayData *dest) |
Copies the contents into a new object. More... | |