MD-Bench/evaluate_gpu_perf_per_thread.sh

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END=32
for ((i=1;i<=END;i++)); do
output=$(eval "NUM_THREADS=$i ./MDBench-NVCC -n 50")
echo "$output" | grep 'atom updates per second' | sed 's/[^0-9.]//g' | awk '{print $1"e6"}'
done