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Commit 5ed9dd65 authored by peastman's avatar peastman
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Merge pull request #427 from peastman/master 

DrudeForce was ignoring force groups (see bug 2012)
parents 509b9b8e 11ef1e01
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plugins/drude/openmmapi/src/DrudeForceImpl.cpp
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...@@ -141,6 +141,7 @@ void DrudeForceImpl::initialize(ContextImpl& context) { ...@@ -141,6 +141,7 @@ void DrudeForceImpl::initialize(ContextImpl& context) {
} }
double DrudeForceImpl::calcForcesAndEnergy(ContextImpl& context, bool includeForces, bool includeEnergy, int groups) { double DrudeForceImpl::calcForcesAndEnergy(ContextImpl& context, bool includeForces, bool includeEnergy, int groups) {
if ((groups&(1<<owner.getForceGroup())) != 0)
return kernel.getAs<CalcDrudeForceKernel>().execute(context, includeForces, includeEnergy); return kernel.getAs<CalcDrudeForceKernel>().execute(context, includeForces, includeEnergy);
} }
......
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