# | Line 81 | Line 81 | namespace OpenMD { | |
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81 | nHBonds_.resize(nBins_); | |
82 | nDonor_.resize(nBins_); | |
83 | nAcceptor_.resize(nBins_); | |
84 | + | |
85 | + | initializeHistogram(); |
86 | } | |
87 | ||
88 | HBondGeometric::~HBondGeometric() { | |
# | Line 96 | Line 98 | namespace OpenMD { | |
98 | nSelected_ = 0; | |
99 | } | |
100 | ||
99 | – | |
100 | – | |
101 | void HBondGeometric::process() { | |
102 | Molecule* mol; | |
103 | StuntDouble* sd1; |
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