if (ed)
{
- do_flood(fplog,cr,x,f,ed,box,step,bNS);
+ do_flood(cr,inputrec,x,f,ed,box,step,bNS);
}
if (bUseOrEmulGPU && !bDiffKernels)
wallcycle_stop(wcycle,ewcWAIT_GPU_NB_L);
/* now clear the GPU outputs while we finish the step on the CPU */
+
+ wallcycle_start_nocount(wcycle,ewcLAUNCH_GPU_NB);
nbnxn_cuda_clear_outputs(nbv->cu_nbv, flags);
+ wallcycle_stop(wcycle,ewcLAUNCH_GPU_NB);
}
else
{
if (ed)
{
- do_flood(fplog,cr,x,f,ed,box,step,bNS);
+ do_flood(cr,inputrec,x,f,ed,box,step,bNS);
}
if (DOMAINDECOMP(cr))