41 |
|
#ifndef APPLICATIONS_STATICPROPS_GOFR_HPP |
42 |
|
#define APPLICATIONS_STATICPROPS_GOFR_HPP |
43 |
|
|
44 |
< |
#include "application/staticProps/RadialDistrFunc.hpp" |
44 |
> |
#include "applications/staticProps/RadialDistrFunc.hpp" |
45 |
|
namespace oopse { |
46 |
|
|
47 |
|
class GofR : public RadialDistrFunc { |
48 |
|
|
49 |
|
public: |
50 |
< |
GofR(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2. double len); |
50 |
> |
GofR(SimInfo* info, const std::string& filename, const std::string& sele1, |
51 |
> |
const std::string& sele2, double len, int nrbins); |
52 |
|
|
53 |
+ |
int getNRBins() { |
54 |
+ |
return nRBins_; |
55 |
+ |
} |
56 |
+ |
|
57 |
+ |
double getLength() { |
58 |
+ |
return len_; |
59 |
+ |
} |
60 |
+ |
|
61 |
|
private: |
62 |
|
|
63 |
|
virtual void preProcess(); |
66 |
|
virtual void processHistogram(); |
67 |
|
|
68 |
|
virtual void writeRdf(); |
69 |
+ |
|
70 |
+ |
double len_; |
71 |
+ |
int nRBins_; |
72 |
+ |
double deltaR_; |
73 |
|
|
74 |
|
std::vector<int> histogram_; |
75 |
|
std::vector<double> avgGofr_; |
63 |
– |
int npairs_; |
76 |
|
}; |
77 |
|
|
78 |
|
} |