File: RMSDMinimizer.sip

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class RMSDMinimizer
{
%TypeHeaderCode
	#include <BALL/STRUCTURE/RMSDMinimizer.h>
	using std::pair;
	using std::vector;
%End

	public:
	typedef vector<Vector3> PointVector;
	typedef pair<Matrix4x4, double> Result;

	static Result computeTransformation(const AtomBijection& ab)
		throw(RMSDMinimizer::IncompatibleCoordinateSets, RMSDMinimizer::TooFewCoordinates);

	static Result computeTransformation(const PointVector& X, const PointVector& Y)
		throw(RMSDMinimizer::IncompatibleCoordinateSets, RMSDMinimizer::TooFewCoordinates);

	static double minimizeRMSD(AtomContainer& a, AtomContainer& b)
		throw(RMSDMinimizer::IncompatibleCoordinateSets, RMSDMinimizer::TooFewCoordinates);
};