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root/group/trunk/OOPSE/libmdtools/MinimizerBase.hpp
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Comparing trunk/OOPSE/libmdtools/MinimizerBase.hpp (file contents):
Revision 975 by tim, Wed Jan 21 22:16:00 2004 UTC vs.
Revision 1023 by tim, Wed Feb 4 22:26:00 2004 UTC

# Line 1 | Line 1
1   #ifndef _MINIMIZERBASE_H_
2   #define _MINIMIZERBASE_H_
3  
4 < class MinimizerBase{
5 <  public:
4 > #include <string>
5 > #include <vector>
6  
7 <    virtual void Minimize() = 0;
8 <    virtual int step() = 0;
9 <    virtual bool testConvergence() = 0;
7 > #include "MinimizerParameterSet.hpp"
8 > #include "NLModel.hpp"
9  
10 <    virtual bool isSolvable() = 0;
10 > #define MINSTATUS_ERROR -1
11 > #define MINSTATUS_CONVERGE 0
12 > #define MINSTATUS_MAXITER 1
13  
14 <    void double setFTol(double tol);
14 <    void double setGradTol(double gradTol);
14 > using namespace std;
15  
16 <    void setStepSize(double step) { stepSize = step;}
17 <    double getStepSize() { return stepSize;}
16 > class MinimizerBase{
17 >  public:
18  
19 <    void setMaxStep(double step) { maxStep = step;}
20 <    double getMaxStep() {return maxStep;}
19 >    //initialize the minimizer method
20 >    virtual void init() = 0;
21  
22 <    const string& getMethodName() {return methodName;}
23 <    void setMethodName(const string& name) { methodName = name;}
22 >    //minimize the model
23 >    virtual void minimize() = 0;
24  
25 <    void setObjFunctor();
26 <    void getObjFunctor();
25 >    //
26 >    virtual int checkConvergence() = 0;
27  
28 < /*
29 <    void setUpdateFunctor();
30 <    void getUpdateFunctor();
28 >    //check whether the model and the method are matched or not    
29 >    virtual bool isSolvable() = 0;
30  
31 <    void setSearchFunctor();
32 <    void getSearchFunctor();
34 < */
31 >    // get the final status of minimization
32 >    int getMinimizationStatus() {return minStatus;}
33  
34 <  protected:
34 >    // get the name of minimization method
35 >    const string getName() {return minimizerName;}
36  
37 <    double stepSize;
38 <    double maxStep;
40 <    double fTol;
41 <    double gradTol;
42 <    string methodName;
37 >    //set the name of minimiation method
38 >    void setName(const string& name) { minimizerName = name;}
39  
40 <    bool hasObjFunctor;
40 >  protected:
41 >    
42 >    int minStatus;
43 >    string minimizerName;
44  
46 /*
47    bool hasUpdateFunctor;
48
49    bool hasSearchFunctor;
50 */
51
45   };
46 +
47   #endif

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