--- trunk/OOPSE/libmdtools/AbstractClasses.hpp	2003/10/29 00:19:10	837
+++ trunk/OOPSE/libmdtools/AbstractClasses.hpp	2004/01/27 19:15:20	987
@@ -1,62 +1,80 @@
-#ifndef _ABSTRACT_CLASSES_H_
-#define _ABSTRACT_CLASSES_H_
-
-#include <string>
-#include "Atom.hpp"
-#ifdef IS_MPI
-
-#include "mpi.h"
-#endif
-
-using namespace std;
-
-class Constraint{
-
-public:
-  Constraint(){}
-  ~Constraint(){}
-
-  int    get_a()             {return a;}
-  void   set_a(int index)    {a = index;}
-  int    get_b()             {return b;}
-  void   set_b(int index)    {b = index;}
-  double get_dsqr()          {return dsqr;}
-  void   set_dsqr(double ds) {dsqr = ds;}
-
-private:
-  int a; /* index of constrained atom a */
-  int b; /* index of constrained atom b */
-  double dsqr; /* the square of the constraint distance */
-};
-
-class SRI{
-
-public:
-  SRI(){ c_potential_E = 0.0; }
-  virtual ~SRI() {}
-
-  virtual void calc_forces() = 0;
-
-  double get_potential(){ return c_potential_E; }
-  virtual int is_constrained() = 0;
-  virtual Constraint *get_constraint() = 0;
-  virtual void constrain(double bond_distance) = 0;
-
-  virtual void printMe( void ) = 0;
-
-protected:
-  double c_potential_E;
-};
-
-
-class BaseIntegrator{
-
-public:
-  BaseIntegrator(){}
-  virtual ~BaseIntegrator(){}
-
-  virtual void integrate( void ) = 0;
-  virtual double  getConservedQuantity(void) = 0;
-  virtual string getAdditionalParameters(void) = 0;
-};
-#endif
+#ifndef _ABSTRACT_CLASSES_H_
+#define _ABSTRACT_CLASSES_H_
+
+#include <string>
+#include "Atom.hpp"
+#ifdef IS_MPI
+
+#include "mpi.h"
+#endif
+
+using namespace std;
+
+class Constraint{
+  public:
+    Constraint(){
+    }
+    ~Constraint(){
+    }
+
+    int get_a(){
+      return a;
+    }
+    void set_a(int index){
+      a = index;
+    }
+    int get_b(){
+      return b;
+    }
+    void set_b(int index){
+      b = index;
+    }
+    double get_dsqr(){
+      return dsqr;
+    }
+    void set_dsqr(double ds){
+      dsqr = ds;
+    }
+
+  private:
+    int a; /* index of constrained atom a */
+    int b; /* index of constrained atom b */
+    double dsqr; /* the square of the constraint distance */
+};
+
+class SRI{
+  public:
+    SRI(){
+      c_potential_E = 0.0;
+    }
+    virtual ~SRI(){
+    }
+
+    virtual void calc_forces() = 0;
+
+    double get_potential(){
+      return c_potential_E;
+    }
+    virtual int is_constrained() = 0;
+    virtual Constraint* get_constraint() = 0;
+    virtual void constrain(double bond_distance) = 0;
+
+    virtual void printMe(void) = 0;
+
+  protected:
+    double c_potential_E;
+};
+
+
+class BaseIntegrator{
+  public:
+    BaseIntegrator(){
+    }
+    virtual ~BaseIntegrator(){
+    }
+
+    virtual void integrate(void) = 0;
+    virtual double getConservedQuantity(void) = 0;
+    virtual string getAdditionalParameters(void) = 0;
+};
+#endif