void computeEnergy(SystemInterface &s) { dds_float box[3]; int per[3]; for (int i=0;i<3;i++) { box[i]=s.box()[i]; per[i] = (PERIODIC(i)); } DipolarDirectSum_kernel_wrapper_energy(k,s.npart_gpu(), s.rGpuBegin(), s.dipGpuBegin(), box,per,(&(((CUDA_energy*)s.eGpu())->dipolar))); };
void computeForces(SystemInterface &s) { dds_float box[3]; int per[3]; for (int i=0;i<3;i++) { box[i]=s.box()[i]; per[i] = (PERIODIC(i)); } DipolarDirectSum_kernel_wrapper_force(k,s.npart_gpu(), s.rGpuBegin(), s.dipGpuBegin(), s.fGpuBegin(),s.torqueGpuBegin(),box,per); };