Added missing getBondedParticles() method

8b3c38f9 · Mark Friedrichs · c23d3c05 · 8b3c38f9
Commit 8b3c38f9 authored Sep 20, 2011 by Mark Friedrichs
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plugins/amoeba/openmmapi/src/AmoebaHarmonicBondForceImpl.cpp plugins/amoeba/openmmapi/src/AmoebaHarmonicBondForceImpl.cpp +9 -0

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--- a/plugins/amoeba/openmmapi/src/AmoebaHarmonicBondForceImpl.cpp
+++ b/plugins/amoeba/openmmapi/src/AmoebaHarmonicBondForceImpl.cpp
@@ -61,3 +61,12 @@ std::vector<std::string> AmoebaHarmonicBondForceImpl::getKernelNames() {
    return names;
 }

+vector<pair<int, int> > AmoebaHarmonicBondForceImpl::getBondedParticles() const {
+    int numBonds = owner.getNumBonds();
+    vector<pair<int, int> > bonds(numBonds);
+    for (int i = 0; i < numBonds; i++) {
+        double length, k;
+        owner.getBondParameters(i, bonds[i].first, bonds[i].second, length, k); 
+    }   
+    return bonds;
+}