5#ifndef BALL_STRUCTURE_UCK_H
6#define BALL_STRUCTURE_UCK_H
8#ifndef BALL_DATATYPE_STRING_H
89 void makePairs(
const std::vector<String>& lambda_map, std::vector<String>& pairs,
const std::vector<vector<Size> >& sp);
98 void createFinalString(
const std::vector<String>& pairs);
105 bool ignore_hydrogens_;
std::vector< std::pair< Size, Size > > PairVector
std::vector< std::vector< Size > > SizeVector
void printUCK(std::ostream &outstr)
const String & getId() const
UCK(const Molecule &mol, bool ignore_hydrogens, Size d=3)
UCK(const Molecule &mol, Size d=3)
const String & getUCK() const
const String & getFormula() const