| [3a21a7] | 1 | /*
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 | 2 |  * Project: MoleCuilder
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 | 3 |  * Description: creates and alters molecular systems
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| [0aa122] | 4 |  * Copyright (C)  2010-2012 University of Bonn. All rights reserved.
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| [94d5ac6] | 5 |  * 
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 | 6 |  *
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 | 7 |  *   This file is part of MoleCuilder.
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 | 8 |  *
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 | 9 |  *    MoleCuilder is free software: you can redistribute it and/or modify
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 | 10 |  *    it under the terms of the GNU General Public License as published by
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 | 11 |  *    the Free Software Foundation, either version 2 of the License, or
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 | 12 |  *    (at your option) any later version.
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 | 13 |  *
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 | 14 |  *    MoleCuilder is distributed in the hope that it will be useful,
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 | 15 |  *    but WITHOUT ANY WARRANTY; without even the implied warranty of
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 | 16 |  *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
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 | 17 |  *    GNU General Public License for more details.
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 | 18 |  *
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 | 19 |  *    You should have received a copy of the GNU General Public License
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 | 20 |  *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>.
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| [3a21a7] | 21 |  */
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 | 22 | 
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 | 23 | /*
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 | 24 |  * CommandLineParser_validate.cpp
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 | 25 |  *
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 | 26 |  *  Created on: Nov 8, 2010
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 | 27 |  *      Author: heber
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 | 28 |  */
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 | 29 | 
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 | 30 | // include config.h
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 | 31 | #ifdef HAVE_CONFIG_H
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 | 32 | #include <config.h>
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 | 33 | #endif
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 | 34 | 
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| [ad011c] | 35 | #include "CodePatterns/MemDebug.hpp"
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| [3a21a7] | 36 | 
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| [d5240d] | 37 | #include <boost/version.hpp>
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 | 38 | 
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| [3a21a7] | 39 | #include <iostream>
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 | 40 | #include <string>
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 | 41 | 
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 | 42 | #include "Actions/Values.hpp"
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 | 43 | #include "CommandLineParser_validate.hpp"
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 | 44 | 
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 | 45 | /** boost::program_options validator specialization for VectorValue.
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 | 46 |  * \param &v  reference for return value
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 | 47 |  * \param &values string vector of scanned options
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 | 48 |  * \param *
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 | 49 |  * \param
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 | 50 |  *
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 | 51 |  */
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 | 52 | void validate(boost::any& v, const std::vector<std::string>& values, VectorValue *, int)
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 | 53 | {
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 | 54 |   VectorValue VV;
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 | 55 |   std::vector<std::string> components;
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 | 56 | 
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 | 57 |   // split comma-separated values
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 | 58 |   if (values.size() != 1) {
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 | 59 |     std::cerr <<  "Not one vector but " << values.size() << " given " << std::endl;
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| [d5240d] | 60 | #if BOOST_VERSION < 104200
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| [3a21a7] | 61 |     throw boost::program_options::validation_error("Unequal to one vector given");
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| [d5240d] | 62 | #else
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 | 63 |     throw boost::program_options::validation_error(
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 | 64 |         boost::program_options::validation_error::invalid_option_value,
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 | 65 |         std::string("value"),
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 | 66 |         std::string("VectorValue")
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 | 67 |     );
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 | 68 | #endif
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| [3a21a7] | 69 |   }
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 | 70 |   std::string argument(values.at(0));
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 | 71 |   std::string::iterator Aiter = argument.begin();
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 | 72 |   std::string::iterator Biter = argument.begin();
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 | 73 |   for (; Aiter != argument.end(); ++Aiter) {
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 | 74 |     if (*Aiter == ',') {
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 | 75 |       components.push_back(std::string(Biter,Aiter));
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 | 76 |       do {
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 | 77 |         Aiter++;
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 | 78 |       } while (*Aiter == ' ' || *Aiter == '\t');
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 | 79 |       Biter = Aiter;
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 | 80 |     }
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 | 81 |   }
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 | 82 |   components.push_back(std::string(Biter,argument.end()));
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 | 83 | 
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 | 84 |   if (components.size() != 3) {
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 | 85 |     std::cerr <<  "Specified vector does not have three components but " << components.size() << std::endl;
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| [d5240d] | 86 | #if BOOST_VERSION < 104200
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| [3a21a7] | 87 |     throw boost::program_options::validation_error("Specified vector does not have three components");
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| [d5240d] | 88 | #else
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 | 89 |     throw boost::program_options::validation_error(
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 | 90 |         boost::program_options::validation_error::invalid_option_value,
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 | 91 |         std::string("value"),
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 | 92 |         std::string("VectorValue")
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 | 93 |     );
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 | 94 | #endif
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| [3a21a7] | 95 |   }
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| [528b3e] | 96 |   for (size_t i=0;i<NDIM;++i)
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 | 97 |     VV.vector[i] = boost::lexical_cast<double>(components.at(i));
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| [3a21a7] | 98 |   v = boost::any(VectorValue(VV));
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 | 99 | }
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 | 100 | 
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| [7d9416] | 101 | void validate(boost::any& v, const std::vector<std::string>& values, RealSpaceMatrixValue *, int)
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| [3a21a7] | 102 | {
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| [7d9416] | 103 |   RealSpaceMatrixValue RSMV;
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| [3a21a7] | 104 |   std::vector<std::string> components;
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 | 105 | 
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 | 106 |   // split comma-separated values
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 | 107 |   if (values.size() != 1) {
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 | 108 |     std::cerr <<  "Not one vector but " << values.size() << " given " << std::endl;
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| [d5240d] | 109 | #if BOOST_VERSION < 104200
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| [3a21a7] | 110 |     throw boost::program_options::validation_error("Unequal to one vector given");
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| [d5240d] | 111 | #else
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 | 112 |     throw boost::program_options::validation_error(
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 | 113 |         boost::program_options::validation_error::invalid_option_value,
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 | 114 |         std::string("value"),
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 | 115 |         std::string("BoxValue")
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 | 116 |     );
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 | 117 | #endif
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| [3a21a7] | 118 |   }
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 | 119 |   std::string argument(values.at(0));
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 | 120 |   std::string::iterator Aiter = argument.begin();
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 | 121 |   std::string::iterator Biter = argument.begin();
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 | 122 |   for (; Aiter != argument.end(); ++Aiter) {
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 | 123 |     if (*Aiter == ',') {
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 | 124 |       components.push_back(std::string(Biter,Aiter));
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 | 125 |       do {
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 | 126 |         Aiter++;
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 | 127 |       } while (*Aiter == ' ' || *Aiter == '\t');
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 | 128 |       Biter = Aiter;
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 | 129 |     }
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 | 130 |   }
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 | 131 |   components.push_back(std::string(Biter,argument.end()));
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 | 132 | 
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 | 133 |   if (components.size() != 6) {
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 | 134 |     std::cerr <<  "Specified vector does not have three components but " << components.size() << std::endl;
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| [d5240d] | 135 | #if BOOST_VERSION < 104200
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| [3a21a7] | 136 |     throw boost::program_options::validation_error("Specified symmetric box matrix does not have six components");
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| [d5240d] | 137 | #else
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 | 138 |     throw boost::program_options::validation_error(
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 | 139 |         boost::program_options::validation_error::invalid_option_value,
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 | 140 |         std::string("value"),
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 | 141 |         std::string("BoxValue")
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 | 142 |     );
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 | 143 | #endif
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| [3a21a7] | 144 |   }
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| [528b3e] | 145 |   for (size_t i=0;i<(NDIM*(NDIM+1))/2; ++i)
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| [7d9416] | 146 |     RSMV.matrix[i] = boost::lexical_cast<double>(components.at(i));
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 | 147 |   v = boost::any(RealSpaceMatrixValue(RSMV));
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| [3a21a7] | 148 | }
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 | 149 | 
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 | 150 | /** boost::program_options validator specialization for boost::filesystem::path.
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 | 151 |  * \param &v  reference for return value
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 | 152 |  * \param &values string vector of scanned options
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 | 153 |  * \param *
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 | 154 |  * \param
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 | 155 |  *
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 | 156 |  */
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 | 157 | void validate(boost::any& v, const std::vector<std::string>& values, boost::filesystem::path *, int)
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 | 158 | {
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 | 159 |   boost::filesystem::path filename;
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 | 160 | 
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 | 161 |   std::cerr << "boost::filesystem::path validator used." << std::endl;
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 | 162 | 
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 | 163 |   // split comma-separated values
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 | 164 |   if (values.size() != 1) {
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 | 165 |     std::cerr <<  "Not one file but " << values.size() << " given " << std::endl;
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| [d5240d] | 166 | #if BOOST_VERSION < 104200
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| [3a21a7] | 167 |     throw boost::program_options::validation_error("Unequal to one file given");
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| [d5240d] | 168 | #else
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 | 169 |     if (values.size() == 0) {
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 | 170 |       throw boost::program_options::validation_error(
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 | 171 |           boost::program_options::validation_error::at_least_one_value_required,
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 | 172 |           std::string("value"),
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 | 173 |           std::string("boost::filesystem::path")
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 | 174 |       );
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 | 175 |     } else {
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 | 176 |       throw boost::program_options::validation_error(
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 | 177 |           boost::program_options::validation_error::multiple_values_not_allowed,
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 | 178 |           std::string("value"),
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 | 179 |           std::string("boost::filesystem::path")
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 | 180 |       );
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 | 181 |     }
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 | 182 | #endif
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| [3a21a7] | 183 |   }
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 | 184 |   filename = values.at(0);
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 | 185 |   v = boost::any(boost::filesystem::path(filename));
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 | 186 | }
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 | 187 | 
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