# | Line 2 | Line 2 | |
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2 | ||
3 | ||
4 | #include "Molecule.hpp" | |
5 | + | #include "simError.h" |
6 | ||
7 | ||
8 | ||
# | Line 101 | Line 102 | double Molecule::getPotential( void ){ | |
102 | ||
103 | return myPot; | |
104 | } | |
105 | + | |
106 | + | void Molecule::printMe( void ){ |
107 | + | |
108 | + | int i; |
109 | + | |
110 | + | for(i=0; i<nBonds; i++){ |
111 | + | myBonds[i]->printMe(); |
112 | + | } |
113 | + | |
114 | + | for(i=0; i<nBends; i++){ |
115 | + | myBends[i]->printMe(); |
116 | + | } |
117 | + | |
118 | + | for(i=0; i<nTorsions; i++){ |
119 | + | myTorsions[i]->printMe(); |
120 | + | } |
121 | + | } |
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