| [a443e1] | 1 | /*
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 | 2 |  * Project: MoleCuilder
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 | 3 |  * Description: creates and alters molecular systems
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 | 4 |  * Copyright (C)  2017 Frederik Heber. All rights reserved.
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 | 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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 | 21 |  */
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 | 22 | 
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 | 23 | /*
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 | 24 |  * Value_vector.cpp
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 | 25 |  *
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 | 26 |  *  Created on: Mar 29, 2017
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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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 | 35 | //#include "CodePatterns/MemDebug.hpp"
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 | 36 | 
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 | 37 | #include "Value_vector.hpp"
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 | 38 | 
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 | 39 | #include <boost/lexical_cast.hpp>
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 | 40 | #include <boost/tokenizer.hpp>
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 | 41 | 
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 | 42 | #include "Geometry/GeometryRegistry.hpp"
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 | 43 | #include "World.hpp"
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 | 44 | 
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 | 45 | const Vector Value<Vector>::parseAsVector(const std::string &_value)
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 | 46 | {
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 | 47 |   Vector temp;
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 | 48 |   if (GeometryRegistry::getInstance().isPresentByName(_value)) {
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 | 49 |     temp = GeometryRegistry::getInstance().getByName(_value)->getVector();
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 | 50 |     LOG(4, "DEBUG: Using stored vector '" << _value << "' from geometry registry.");
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 | 51 |   } else {
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 | 52 |     // dissect by ","
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 | 53 |     typedef boost::tokenizer<boost::char_separator<char> > tokenizer;
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 | 54 |     boost::char_separator<char> value_separator(",)( ");
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 | 55 | 
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 | 56 |     bool status = true;
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 | 57 |     tokenizer tokens(_value, value_separator);
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 | 58 |     if (!_value.empty()) {
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 | 59 |       tokenizer::iterator tok_iter = tokens.begin();
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 | 60 |       for (size_t i=0;i<NDIM;++i) {
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 | 61 |         if (tok_iter == tokens.end()) {
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 | 62 |           status = false;
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 | 63 |           break;
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 | 64 |         }
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 | 65 |         try {
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 | 66 |           temp[i] = boost::lexical_cast<double>(*(tok_iter++));
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 | 67 |         } catch (boost::bad_lexical_cast &e) {
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 | 68 |           throw ParameterValueException();
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 | 69 |         }
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 | 70 |       }
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 | 71 | //      if (tok_iter != tokens.end())
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 | 72 | //        ELOG(2, "There are still components left: " << *tok_iter << "?");
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 | 73 |     }
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 | 74 |     if (!status)
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 | 75 |       temp.Zero();
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 | 76 |   }
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 | 77 |   return temp;
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 | 78 | }
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 | 79 | 
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 | 80 | const std::string Value<Vector>::setFromVector(const Vector &_vec)
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 | 81 | {
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 | 82 |   std::stringstream output;
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 | 83 |   for (size_t i=0;i<NDIM;++i) {
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 | 84 |     if (i!=0)
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 | 85 |       output << ",";
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 | 86 |     output << _vec;
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 | 87 |   }
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 | 88 |   return output.str();
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 | 89 | }
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 | 90 | 
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 | 91 | /** Here come the modified functions.
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 | 92 |  *
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 | 93 |  */
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 | 94 | 
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 | 95 | const Vector & Value<Vector>::get() const throw(ParameterValueException)
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 | 96 | {
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 | 97 |   converted_value = parseAsVector(value);
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 | 98 |   if (!ValueSet) throw ParameterValueException();
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 | 99 |   if (!isValid(converted_value)) throw ParameterValueException();
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 | 100 |   return converted_value;
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 | 101 | }
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 | 102 | 
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 | 103 | const Vector & Value<Vector>::getUnvalidated() const throw(ParameterValueException)
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 | 104 | {
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 | 105 |   converted_value = parseAsVector(value);
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 | 106 |   if (!ValueSet) throw ParameterValueException();
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 | 107 |   return converted_value;
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 | 108 | }
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 | 109 | 
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 | 110 | /** Here are the original functions that we simply copied.
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 | 111 |  *
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 | 112 |  */
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 | 113 | 
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 | 114 | Value<Vector>::Value() :
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 | 115 |   ValueSet(false),
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 | 116 |   validator(new DummyValidator<Vector>)
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 | 117 | {}
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 | 118 | 
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 | 119 | Value<Vector>::Value(const Validator<Vector> &_validator) :
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 | 120 |   ValueSet(false),
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 | 121 |   validator(_validator.clone())
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 | 122 | {}
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 | 123 | 
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 | 124 | Value<Vector>::Value(const std::vector<Vector> &_ValidValues) :
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 | 125 |   ValueSet(false),
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 | 126 |   validator(NULL)
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 | 127 | {
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 | 128 |   validator = new DiscreteValidator<Vector>(_ValidValues);
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 | 129 | }
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 | 130 | 
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 | 131 | Value<Vector>::Value(const range<Vector> &_ValidRange) :
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 | 132 |   ValueSet(false),
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 | 133 |   validator(NULL)
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 | 134 | {
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 | 135 |   validator = new RangeValidator<Vector>(_ValidRange);
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 | 136 | }
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 | 137 | 
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 | 138 | Value<Vector>::~Value()
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 | 139 | {
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 | 140 |   ASSERT(validator,
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 | 141 |       "Value<Vector>::~Value() - validator missing.");
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 | 142 |   delete(validator);
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 | 143 | }
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 | 144 | 
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 | 145 | bool Value<Vector>::isValid(const Vector & _value) const throw(ParameterValidatorException)
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 | 146 | {
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 | 147 |   if (validator == NULL) throw ParameterValidatorException();
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 | 148 |   return (*validator)(_value);
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 | 149 | }
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 | 150 | 
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 | 151 | 
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 | 152 | bool Value<Vector>::operator==(const Value<Vector> &_instance) const throw(ParameterValidatorException)
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 | 153 | {
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 | 154 |   if (validator == NULL) throw ParameterValidatorException();
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 | 155 |   if (_instance.validator == NULL) throw ParameterValidatorException();
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 | 156 |   bool status = true;
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 | 157 |   status = status && (*validator == *_instance.validator);
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 | 158 |   status = status && (ValueSet == _instance.ValueSet);
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 | 159 |   if (ValueSet && _instance.ValueSet)
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 | 160 |     status = status && (value == _instance.value);
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 | 161 |   return status;
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 | 162 | }
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 | 163 | 
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 | 164 | void Value<Vector>::set(const Vector & _value) throw(ParameterException)
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 | 165 | {
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 | 166 |   // any value may be set, this allows Actions to have invalid parameters
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 | 167 |   // (e.g. because the given atom id does not yet exist) that are checked
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 | 168 |   // on performCall()
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 | 169 | //  if (!isValid(_value)) throw ParameterValueException();
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 | 170 |   if (!ValueSet)
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 | 171 |     ValueSet = true;
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 | 172 |   value = setFromVector(_value);
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 | 173 | }
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 | 174 | 
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 | 175 | 
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 | 176 | bool Value<Vector>::isSet() const
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 | 177 | {
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 | 178 |   return ValueSet;
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 | 179 | }
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 | 180 | 
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 | 181 | 
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 | 182 | bool Value<Vector>::isValidAsString(const std::string &_value) const throw(ParameterValidatorException)
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 | 183 | {
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 | 184 |   const Vector castvalue = parseAsVector(_value);
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 | 185 | //  LOG(0, "Converted value reads " << castvalue <<".");
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 | 186 |   return isValid(castvalue);
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 | 187 | }
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 | 188 | 
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 | 189 | 
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 | 190 | const std::string Value<Vector>::getAsString() const throw(ParameterValueException)
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 | 191 | {
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| [ddceb1] | 192 |   converted_value = parseAsVector(value);
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 | 193 |   if (!ValueSet) throw ParameterValueException();
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 | 194 |   if (!isValid(converted_value)) throw ParameterValueException();
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| [a443e1] | 195 |   return value;
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 | 196 | }
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 | 197 | 
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| [ddceb1] | 198 | const std::string Value<Vector>::getAsStringUnvalidated() const throw(ParameterValueException)
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 | 199 | {
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 | 200 |   if (!ValueSet) throw ParameterValueException();
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 | 201 |   return value;
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 | 202 | }
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| [a443e1] | 203 | 
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 | 204 | void Value<Vector>::setAsString(const std::string &_value) throw(ParameterException)
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 | 205 | {
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 | 206 |   if (!ValueSet)
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 | 207 |     ValueSet = true;
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 | 208 |   value = _value;
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 | 209 | //  LOG(0, "STATUS: Value is now set to " << value << ".");
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 | 210 | }
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 | 211 | 
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 | 212 | 
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 | 213 | const Validator<Vector> &Value<Vector>::getValidator() const
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 | 214 | {
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 | 215 |   if (validator == NULL) throw ParameterValidatorException();
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 | 216 |   return *validator;
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 | 217 | }
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 | 218 | 
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 | 219 | 
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 | 220 | Validator<Vector> &Value<Vector>::getValidator()
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 | 221 | {
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 | 222 |   if (validator == NULL) throw ParameterValidatorException();
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 | 223 |   return *validator;
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 | 224 | }
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 | 225 | 
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 | 226 | 
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 | 227 | const range<Vector> & Value<Vector>::getValidRange() const throw(ParameterValidatorException)
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 | 228 | {
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 | 229 |   return dynamic_cast<const RangeValidator<Vector>&>(getValidator()).getValidRange();
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 | 230 | }
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 | 231 | 
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 | 232 | 
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 | 233 | void Value<Vector>::setValidRange(const range<Vector> &_range) throw(ParameterValueException)
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 | 234 | {
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 | 235 |   dynamic_cast<RangeValidator<Vector>&>(getValidator()).setValidRange(_range);
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 | 236 |   if (ValueSet) {
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 | 237 |       //std::cout << "Checking whether " << value << " is in range " << _range << "." << std::endl;
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 | 238 |     if (!isValid(converted_value)){
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 | 239 |       //std::cout << "ValueSet to false." << std::endl;
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 | 240 |       ValueSet = false;
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 | 241 |       // have full check again in assert such that it appears in output, too
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 | 242 |       throw ParameterValueException() << ParameterValidValues(toString(_range));
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 | 243 |     }
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 | 244 |   }
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 | 245 |   //  LOG(0, "STATUS: Valid range is now " << ValidRange << ".");
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 | 246 | }
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 | 247 | 
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 | 248 | void Value<Vector>::appendValidValue(const Vector &_value) throw(ParameterValidatorException)
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 | 249 | {
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 | 250 |   dynamic_cast<DiscreteValidator<Vector>&>(getValidator()).appendValidValue(_value);
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 | 251 | }
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 | 252 | 
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 | 253 | const std::vector<Vector> &Value<Vector>::getValidValues() const throw(ParameterValidatorException)
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 | 254 | {
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 | 255 |   return dynamic_cast<const DiscreteValidator<Vector>&>(getValidator()).getValidValues();
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 | 256 | }
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 | 257 | 
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