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* |
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* Created by Charles F. Vardeman II on 11/15/05. |
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* @author Charles F. Vardeman II |
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* @version $Id: OptionSectionParser.hpp,v 1.1 2005-11-16 21:37:41 chuckv Exp $ |
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* @version $Id: OptionSectionParser.hpp,v 1.2 2005-11-16 23:10:02 tim Exp $ |
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* |
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*/ |
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#ifndef IO_OPTIONSECTIONPARSER_HPP |
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#define IO_OPTIONSECTIONPARSER_HPP |
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#include "io/ForceFieldOptions.hpp" |
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#include "io/SectionParser.hpp" |
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#include "types/AtomType.hpp" |
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namespace oopse { |
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/** |
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* @class OptionSectionParser OptionSectionParser.hpp "io/OptionSectionParser.hpp" |
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*/ |
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class OptionSectionParser : public SectionParser { |
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public: |
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OptionSectionParser(); |
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DeclareParameter(MixingRule, std::string); |
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OptionSectionParser(ForceFieldOptions& options); |
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virtual void validateSection(); |
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private: |
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virtual void parseLine(ForceField& ff, const std::string& line, int lineNo); |
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ForceFieldOptions& options_; |
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typedef std::map<std::string, ParameterBase*> ParamMap; |
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ParamMap parameters_; |
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}; |
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