Fixed bug in calculateTotalDipoles in AmoebaReferenceKernels.cpp

d1a86459 · Saurabh Belsare · 3e9dc091 · d1a86459
Commit d1a86459 authored Feb 04, 2016 by Saurabh Belsare
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plugins/amoeba/platforms/reference/src/AmoebaReferenceKernels.cpp ...amoeba/platforms/reference/src/AmoebaReferenceKernels.cpp +1 -1

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--- a/plugins/amoeba/platforms/reference/src/AmoebaReferenceKernels.cpp
+++ b/plugins/amoeba/platforms/reference/src/AmoebaReferenceKernels.cpp
@@ -743,7 +743,7 @@ void ReferenceCalcAmoebaMultipoleForceKernel::getTotalDipoles(ContextImpl& conte
    vector<RealVec> totalDipoles;
    amoebaReferenceMultipoleForce->calculateTotalDipoles(posData, charges, dipoles, quadrupoles, tholes,
-            dampingFactors, polarity, axisTypes, multipoleAtomZs, multipoleAtomXs, multipoleAtomYs, multipoleAtomCovalentInfo, inducedDipoles);
+            dampingFactors, polarity, axisTypes, multipoleAtomZs, multipoleAtomXs, multipoleAtomYs, multipoleAtomCovalentInfo, totalDipoles);
    for (int i = 0; i < numParticles; i++)
        outputDipoles[i] = totalDipoles[i];