1 | /*
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2 | * writeDistanceEnergyTable.hpp
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3 | *
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4 | * Created on: Nov 20, 2012
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5 | * Author: heber
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6 | */
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7 |
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8 | #ifndef WRITEDISTANCEENERGYTABLE_HPP_
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9 | #define WRITEDISTANCEENERGYTABLE_HPP_
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10 |
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11 |
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12 | // include config.h
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13 | #ifdef HAVE_CONFIG_H
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14 | #include <config.h>
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15 | #endif
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16 |
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17 | #include <vector>
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18 | #include <sstream>
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19 | #include <string>
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20 |
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21 | namespace _detail {
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22 |
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23 | typedef std::vector<double> values_t;
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24 | typedef std::vector< values_t > DistanceEnergyTable_t;
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25 |
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26 | /** Gets the number of column entries, i.e. number of rows.
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27 | *
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28 | * \note ASSERT's that all columns have equal number of entries
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29 | *
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30 | * @param table table to check
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31 | * @return number of column entries
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32 | */
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33 | const size_t checkNumberOfColumnEntries(const DistanceEnergyTable_t &table)
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34 | {
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35 | size_t index = table[0].size();
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36 | for (DistanceEnergyTable_t::const_iterator coliter = table.begin();
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37 | coliter != table.end(); ++coliter)
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38 | ASSERT( (*coliter).size() == index,
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39 | "writeDistanceEnergyTable() - mismatch in column sizes.");
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40 | return index;
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41 | }
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42 |
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43 | /** Pretty prints the given distance-energy table.
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44 | *
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45 | * @param table table to print
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46 | * @return string containing pretty-printed table
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47 | */
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48 | const std::string writeDistanceEnergyTable(const DistanceEnergyTable_t &table)
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49 | {
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50 | std::stringstream returnstream;
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51 |
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52 | if (table.size() > 0) {
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53 | /// check each column for equal number of entries
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54 | const size_t indices = checkNumberOfColumnEntries(table);
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55 |
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56 | /// print header line
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57 | for (size_t index = 0; index < indices-1; ++index)
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58 | returnstream << "distance" << index+1 << "\t";
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59 | returnstream << "energy" << std::endl;
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60 |
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61 | /// print each row
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62 | for (DistanceEnergyTable_t::const_iterator coliter = table.begin();
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63 | coliter != table.end(); ++coliter) {
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64 | for (DistanceEnergyTable_t::value_type::const_iterator rowiter = (*coliter).begin();
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65 | rowiter != (*coliter).end(); ++rowiter) {
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66 | returnstream << (*rowiter) << "\t";
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67 | }
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68 | returnstream << std::endl;
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69 | }
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70 | }
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71 |
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72 | return returnstream.str();
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73 | }
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74 |
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75 | }; /* namespace _detail */
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76 |
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77 | #endif /* WRITEDISTANCEENERGYTABLE_HPP_ */
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