#include <vector>
#include <cmath>
#include "Atoms.h"
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Functions | |
std::string | convertToString (const int n) |
double | distance (double *P1, double *P2) |
int | giveNumberOfOA (const std::string &atom) |
int | posAtomInString (std::string &atomName) |
void | readPartitionAndSetColor (std::ifstream &part, std::vector< std::string > &color) |
void | renumLinear (setOfAtoms &atomsSet, std::vector< int > &newNumerotation) |
bool | skipString (std::ifstream &data, const std::string &keyword) |
void | sortInFirstDimension (setOfAtoms &atoms, std::vector< int > &newNum) |
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Definition at line 31 of file newTools.h. |
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Definition at line 59 of file newTools.h. Referenced by AAPartition::setNeigboors(). |
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Definition at line 8 of file newTools.cpp. |
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Definition at line 37 of file newTools.h. Referenced by PDBstructure::writeQCIFile(), PDBstructure::writeXYZFile(), and PDBstructure::writeXYZFileForAtoms(). |
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Definition at line 84 of file newTools.cpp. |
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Definition at line 46 of file tools.cpp. Referenced by main(). |
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Definition at line 23 of file newTools.cpp. |
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Definition at line 40 of file newTools.cpp. |