• 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.h 11.4 KB