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MolData Member List

This is the complete list of members for MolData, including all inherited members.

actual_radius	MolData
basisa	MolData
basisb	MolData
basisc	MolData
coords	MolData
count	MolData
findAtomsGrid(const AtomGrid *grid)	MolData
getActualRadius() const	MolData	[inline]
getRadius() const	MolData	[inline]
gridspacing	MolData
MolData()	MolData	[inline]
origin	MolData
periodic	MolData
radius	MolData
readData(const int *indx, const float *coords, const int count, const Vector3D o, const Vector3D a, const Vector3D b, const Vector3D c, const double gridspacing, const double radius, const double threshold, const bool periodic)	MolData	[static]
readFile(const char *fname, double gridspacing, double radius, double threshold)	MolData	[static]
threshold	MolData
wrapCoords(const AtomGrid *grid)	MolData
~MolData()	MolData	[inline]

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