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Protein-protein docking on hardware accelerators: comparison of GPU and MIC architectures

机译:蛋白质 - 蛋白质对接硬件加速器:GPU和MIC架构的比较

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Background: The hardware accelerators will provide solutions to computationally complex problems in bioinformatics fields. However, the effect of acceleration depends on the nature of the application, thus selection of an appropriate accelerator requires some consideration.Results: In the present study, we compared the effects of acceleration using graphics processing unit (GPU) and many integrated core (MIC) on the speed of fast Fourier transform (FFT)-based protein-protein docking calculation. The GPU implementation performed the protein-protein docking calculations approximately five times faster than the MIC offload mode implementation. The MIC native mode implementation has the advantage in the implementation costs. However, the performance was worse with larger protein pairs because of memory limitations.Conclusion: The results suggest that GPU is more suitable than MIC for accelerating FFT-based protein-protein docking applications.
机译:背景:硬件加速器将为生物信息系统领域的计算复杂问题提供解决方案。然而,加速度的效果取决于应用的性质,因此选择适当的加速器需要一些考虑。结果:在本研究中,我们使用图形处理单元(GPU)和许多集成核心加速的影响(MIC关于快速傅里叶变换(FFT)的速率 - 基于蛋白质 - 蛋白质对接计算的速度。 GPU实现对蛋白质 - 蛋白质对接计算比MIC卸载模式实现快约五倍。 MIC本机模式实现具有实施成本的优势。然而,由于内存限制,蛋白质对具有较大的蛋白质对更差。结果表明GPU比MIC更适合于加速基于FFT的蛋白质对接应用。

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