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  • Peter Eastman's avatar
    Optimize updateParametersInContext() (#4610) · 78902bed
    Peter Eastman authored 
    * Optimize CustomNonbondedForce.updateParametersInContext()

* Optimized uploading changed values to GPU

* Optimized updateParametersInContext() for lots of bonded forces

* Optimized updateParametersInContext() for CustomExternalForce

* Optimized updateParametersInContext() for NonbondedForce

* Code changes for HIP platform
    78902bed
CudaKernels.cpp 61.5 KB