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* [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). |
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* [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). |
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* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). |
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* [4] Vardeman & Gezelter, in progress (2009). |
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* |
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* [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010). |
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* [4] , Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). * |
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* ParameterManager.hpp |
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* |
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* Created by Charles F. Vardeman II on 11/16/05. |
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* @author Charles F. Vardeman II |
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* @version $Id: ParameterManager.hpp,v 1.6 2009-11-25 20:02:04 gezelter Exp $ |
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* @version $Id$ |
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* |
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*/ |
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#define UTILS_PARAMETERMANAGER_HPP |
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#include <iostream> |
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#include <cstdio> |
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#include <stdlib.h> |
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#include <vector> |
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bool have##NAME() { return !NAME.empty();} \ |
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TYPE get##NAME() { return NAME.getData();} |
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#define DeclareAlterableParameter(NAME, TYPE) \ |
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private: \ |
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Parameter<TYPE> NAME; \ |
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public: \ |
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bool have##NAME() { return !NAME.empty();} \ |
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TYPE get##NAME() { return NAME.getData();} \ |
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bool set##NAME(TYPE s) { return NAME.setData(s);} \ |
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#define DefineParameter(NAME,KEYWORD) \ |
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NAME.setKeyword(KEYWORD); \ |
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parameters_.insert(std::map<std::string, ParameterBase*>::value_type(std::string(KEYWORD), static_cast<ParameterBase*>(&NAME))); |
