mrcdensitymapheader.cpp File Reference

#include "gmxpre.h"
#include "mrcdensitymapheader.h"
#include <cstdint>
#include <algorithm>
#include <iterator>
#include "gromacs/mdspan/extents.h"
#include "gromacs/utility/exceptions.h"
#include "gromacs/utility/real.h"

Include dependency graph for mrcdensitymapheader.cpp:

Description

Implement mrc/ccp4-file metadata.

Author

Christian Blau blau@.nosp@m.kth..nosp@m.se

Functions
template<typename Container >
bool	gmx::anonymous_namespace{mrcdensitymapheader.cpp}::anySmallerZero (const Container &values)
	Returns true if any of the argument values is smaller than zero.
template<typename Container >
bool	gmx::anonymous_namespace{mrcdensitymapheader.cpp}::anyLargerThanValue (const Container &values, typename Container::value_type boundaryValue)
	Returns true if any of the argument values is larger than a given boundary value.
size_t	gmx::numberOfExpectedDataItems (const MrcDensityMapHeader &header)
	Return the number of density data items that are expected to follow this header. More...
TranslateAndScale	gmx::getCoordinateTransformationToLattice (const MrcDensityMapHeader &header)
	Extract the transformation into lattice coordinates. More...
dynamicExtents3D	gmx::getDynamicExtents3D (const MrcDensityMapHeader &header)
	Extract the extents of the density data. More...
bool	gmx::mrcHeaderIsSane (const MrcDensityMapHeader &header)
	Checks if the values in the header are sane. More...