Bug fix to updateParametersInContext() for AmoebaWcaDispersionForce

557fbb68 · Peter Eastman · 0df0e673 · 557fbb68
Commit 557fbb68 authored Nov 27, 2012 by Peter Eastman
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plugins/amoeba/platforms/reference/src/AmoebaReferenceKernels.cpp ...amoeba/platforms/reference/src/AmoebaReferenceKernels.cpp +1 -0

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--- a/plugins/amoeba/platforms/reference/src/AmoebaReferenceKernels.cpp
+++ b/plugins/amoeba/platforms/reference/src/AmoebaReferenceKernels.cpp
@@ -1050,4 +1050,5 @@ void ReferenceCalcAmoebaWcaDispersionForceKernel::copyParametersToContext(Contex
        radii[i] = (RealOpenMM) radius;
        epsilons[i] = (RealOpenMM) epsilon;
    }
+    totalMaximumDispersionEnergy = (RealOpenMM) AmoebaWcaDispersionForceImpl::getTotalMaximumDispersionEnergy(force);
 }