XDSIO::XDSunmergeFile Class Reference

Public Member Functions
	XDSunmergeFile (const std::string &xdsName, const int &verbose, std::string &output)
	constructor from file name
void	init (const std::string &xdsName, const int &verbose, std::string &output)
	init from file name
scala::FileRead	FillHklList (std::string &output, const int &verbose, scala::hkl_unmerge_list &hkl_list)
	Fill an hkl_unmerge_list object from this file with default options.
scala::FileRead	AddHklList (const scala::file_select &file_sel, const scala::all_controls &controls, const scala::PxdName &InputPxdName, const scala::Scell &newcell, std::string &output, const int &verbose, scala::hkl_unmerge_list &hkl_list)
	Fill an hkl_unmerge_list object from this file.
int	Ncols () const
scala::SpaceGroup	Spacegroup () const
	return SpaceGroup object if known, or blank
scala::Scell	Cell () const
	return cell

Member Function Documentation

scala::FileRead XDSIO::XDSunmergeFile::AddHklList	(	const scala::file_select &	file_sel,
		const scala::all_controls &	controls,
		const scala::PxdName &	InputPxdName,
		const scala::Scell &	newcell,
		std::string &	output,
		const int &	verbose,
		scala::hkl_unmerge_list &	hkl_list
	)

Fill an hkl_unmerge_list object from this file.

On entry: xdsname name of XDS file (or logical name) file_sel flags for general selection

dataset selection
batch selection
resolution limits
detector coordinate rejection ranges only resolution limits used at present controls run controls InputPxdName PXD name (none in XDS file) newcell if non-null, override cell output output string for printing verbose set verbosity level = 0 silent, = +1 usual summary >= +2 debug

On exit: hkl_list has been filled, but not organised: this needs a call to "prepare" or "change_symmetry"

The documentation for this class was generated from the following files: