OptimizationCreator.hpp

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 *
 * SUPPORT OPEN SCIENCE!  If you use OpenMD or its source code in your
 * research, please cite the following paper when you publish your work:
 *
 * [1] Drisko et al., J. Open Source Softw. 9, 7004 (2024).
 *
 * Good starting points for code and simulation methodology are:
 *
 * [2] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005).
 * [3] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006).
 * [4] Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008).
 * [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011).
 * [6] Kuang & Gezelter, Mol. Phys., 110, 691-701 (2012).
 * [7] Lamichhane, Gezelter & Newman, J. Chem. Phys. 141, 134109 (2014).
 * [8] Bhattarai, Newman & Gezelter, Phys. Rev. B 99, 094106 (2019).
 * [9] Drisko & Gezelter, J. Chem. Theory Comput. 20, 4986-4997 (2024).
 */
 
#ifndef OPTIMIZATION_OPTIMIZATIONCREATOR_HPP
#define OPTIMIZATION_OPTIMIZATIONCREATOR_HPP
 
#include <string>
 
#include "optimization/Method.hpp"
 
using namespace QuantLib;
namespace OpenMD {
 
  class OptimizationMethod;
  class SimInfo;
 
  class OptimizationCreator {
  public:
    OptimizationCreator(const std::string& ident) : ident_(ident) {}
    virtual ~OptimizationCreator() {}
    const std::string& getIdent() const { return ident_; }
    virtual QuantLib::OptimizationMethod* create() const = 0;
 
  private:
    std::string ident_;
  };
 
  template<class ConcreteOptimization>
  class OptimizationBuilder : public OptimizationCreator {
  public:
    OptimizationBuilder(const std::string& ident) :
        OptimizationCreator(ident) {}
    virtual QuantLib::OptimizationMethod* create() const {
      return new ConcreteOptimization();
    }
  };
}  // namespace OpenMD
 
#endif  // OPTIMIZATIONS_OPTIMIZATIONCREATOR_HPP