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Comparing branches/new_design/OOPSE-4/src/brains/Stats.cpp (file contents):
Revision 1831 by tim, Thu Dec 2 02:08:29 2004 UTC vs.
Revision 1832 by tim, Thu Dec 2 16:04:19 2004 UTC

# Line 41 | Line 41 | Stats::Stats() {
41  
42      if (!isInit_) {
43          init();
44 <        isInit_ = false;
44 >        isInit_ = true;
45      }
46  
47   }
48  
49   void Stats::init() {
50  
51 <    title_[TIME] = "Time";
52 <    title_[TOTAL_ENERGY] = "Total Energy";
53 <    title_[POTENTIAL_ENERGY] = "Potential Energy";
54 <    title_[KINETIC_ENERGY] = "Kinetic Energy";
55 <    title_[TEMPERATURE] = "Temperature";
56 <    title_[PRESSURE] = "Pressure";
57 <    title_[VOLUME] = "Volume";
58 <    title_[CONSERVED_QUANTITY] = "Conserved Quantity";            
59 <    title_[TRANSLATIONAL_KINETIC] = "Translational Kinetic";
60 <    title_[ROTATIONAL_KINETIC] = "Rotational Kinetic";
61 <    title_[LONG_RANGE_POTENTIAL] = "Long Range Potential";
62 <    title_[SHORT_RANGE_POTENTIAL] = "Short Range Potential";
63 <    title_[VANDERWAALS_POTENTIAL] = "van der waals Potential";
64 <    title_[BOND_POTENTIAL] = "Bond Potential";
65 <    title_[BEND_POTENTIAL] = "Bend Potential";
66 <    title_[DIHEDRAL_POTENTIAL] = "Dihedral Potential";
67 <    title_[IMPROPER_POTENTIAL] = "Improper Potential";
68 <    title_[VRAW] = "Raw Potential";
69 <    title_[VHARM] = "Harmonic Potential";
51 >    Stats::title_[TIME] = "Time";
52 >    Stats::title_[TOTAL_ENERGY] = "Total Energy";
53 >    Stats::title_[POTENTIAL_ENERGY] = "Potential Energy";
54 >    Stats::title_[KINETIC_ENERGY] = "Kinetic Energy";
55 >    Stats::title_[TEMPERATURE] = "Temperature";
56 >    Stats::title_[PRESSURE] = "Pressure";
57 >    Stats::title_[VOLUME] = "Volume";
58 >    Stats::title_[CONSERVED_QUANTITY] = "Conserved Quantity";            
59 >    Stats::title_[TRANSLATIONAL_KINETIC] = "Translational Kinetic";
60 >    Stats::title_[ROTATIONAL_KINETIC] = "Rotational Kinetic";
61 >    Stats::title_[LONG_RANGE_POTENTIAL] = "Long Range Potential";
62 >    Stats::title_[SHORT_RANGE_POTENTIAL] = "Short Range Potential";
63 >    Stats::title_[VANDERWAALS_POTENTIAL] = "van der waals Potential";
64 >    Stats::title_[BOND_POTENTIAL] = "Bond Potential";
65 >    Stats::title_[BEND_POTENTIAL] = "Bend Potential";
66 >    Stats::title_[DIHEDRAL_POTENTIAL] = "Dihedral Potential";
67 >    Stats::title_[IMPROPER_POTENTIAL] = "Improper Potential";
68 >    Stats::title_[VRAW] = "Raw Potential";
69 >    Stats::title_[VHARM] = "Harmonic Potential";
70  
71 <    units_[TIME] = "fs";
72 <    units_[TOTAL_ENERGY] = "kcal/mol";
73 <    units_[POTENTIAL_ENERGY] = "kcal/mol";
74 <    units_[KINETIC_ENERGY] = "kcal/mol";
75 <    units_[TEMPERATURE] = "K";
76 <    units_[PRESSURE] = "atm";
77 <    units_[VOLUME] = "A^3";
78 <    units_[CONSERVED_QUANTITY] = "kcal/mol";            
79 <    units_[TRANSLATIONAL_KINETIC] = "kcal/mol";
80 <    units_[ROTATIONAL_KINETIC] = "kcal/mol";
81 <    units_[LONG_RANGE_POTENTIAL] = "kcal/mol";
82 <    units_[SHORT_RANGE_POTENTIAL] = "kcal/mol";
83 <    units_[VANDERWAALS_POTENTIAL] = "kcal/mol";
84 <    units_[BOND_POTENTIAL] = "kcal/mol";
85 <    units_[BEND_POTENTIAL] = "kcal/mol";
86 <    units_[DIHEDRAL_POTENTIAL] = "kcal/mol";
87 <    units_[IMPROPER_POTENTIAL] = "kcal/mol";
88 <    units_[VRAW] = "kcal/mol";
89 <    units_[VHARM] = "kcal/mol";
71 >    Stats::units_[TIME] = "fs";
72 >    Stats::units_[TOTAL_ENERGY] = "kcal/mol";
73 >    Stats::units_[POTENTIAL_ENERGY] = "kcal/mol";
74 >    Stats::units_[KINETIC_ENERGY] = "kcal/mol";
75 >    Stats::units_[TEMPERATURE] = "K";
76 >    Stats::units_[PRESSURE] = "atm";
77 >    Stats::units_[VOLUME] = "A^3";
78 >    Stats::units_[CONSERVED_QUANTITY] = "kcal/mol";            
79 >    Stats::units_[TRANSLATIONAL_KINETIC] = "kcal/mol";
80 >    Stats::units_[ROTATIONAL_KINETIC] = "kcal/mol";
81 >    Stats::units_[LONG_RANGE_POTENTIAL] = "kcal/mol";
82 >    Stats::units_[SHORT_RANGE_POTENTIAL] = "kcal/mol";
83 >    Stats::units_[VANDERWAALS_POTENTIAL] = "kcal/mol";
84 >    Stats::units_[BOND_POTENTIAL] = "kcal/mol";
85 >    Stats::units_[BEND_POTENTIAL] = "kcal/mol";
86 >    Stats::units_[DIHEDRAL_POTENTIAL] = "kcal/mol";
87 >    Stats::units_[IMPROPER_POTENTIAL] = "kcal/mol";
88 >    Stats::units_[VRAW] = "kcal/mol";
89 >    Stats::units_[VHARM] = "kcal/mol";
90   }
91  
92   }

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