用量子采样提升深度学习精度,解决生物数据建模难题
Quantum-Boosted High-Fidelity Deep Learning
- 用量子处理器采样玻尔兹曼分布,替代传统高斯先验
- 在百万级单细胞数据上优于经典VAE和SCVI模型
- 为科学发现提供可迁移的量子-经典混合建模范式
概率深度学习的主要局限在于依赖高斯先验,难以捕捉自然数据中复杂的非高斯结构,尤其在复杂生物数据领域严重限制了模型保真度。物理基础的玻尔兹曼分布更具表达力,但经典计算机上计算不可行。现有量子方法受限于量子比特数量和运行稳定性,无法满足深度学习的迭代需求。本文提出量子玻尔兹曼机-变分自编码器(QBM-VAE)架构,利用量子处理器高效采样玻尔兹曼分布,将其作为深度生成模型的强大先验。在多个来源的百万级单细胞数据集上,该模型生成的潜在空间更完整保留复杂生物结构,在组学数据整合、细胞类型分类和轨迹推断等任务中持续优于传统高斯基模型(如VAE、SCVI)。该工作展示了在大规模科学问题上实现实用量子优势的可行性,并提供了可迁移的混合量子-人工智能模型开发蓝图。
原文摘要 · Abstract (English)
A fundamental limitation of probabilistic deep learning is its predominant reliance on Gaussian priors. This simplistic assumption prevents models from accurately capturing the complex, non-Gaussian landscapes of natural data, particularly in demanding domains like complex biological data, severely hindering the fidelity of the model for scientific discovery. The physically-grounded Boltzmann distribution offers a more expressive alternative, but it is computationally intractable on classical computers. To date, quantum approaches have been hampered by the insufficient qubit scale and operational stability required for the iterative demands of deep learning. Here, we bridge this gap by introducing the Quantum Boltzmann Machine-Variational Autoencoder (QBM-VAE), a large-scale and long-time stable hybrid quantum-classical architecture. Our framework leverages a quantum processor for efficient sampling from the Boltzmann distribution, enabling its use as a powerful prior within a deep generative model. Applied to million-scale single-cell datasets from multiple sources, the QBM-VAE generates a latent space that better preserves complex biological structures, consistently outperforming conventional Gaussian-based deep learning models like VAE and SCVI in essential tasks such as omics data integration, cell-type classification, and trajectory inference. It also provides a typical example of introducing a physics priori into deep learning to drive the model to acquire scientific discovery capabilities that breaks through data limitations. This work provides the demonstration of a practical quantum advantage in deep learning on a large-scale scientific problem and offers a transferable blueprint for developing hybrid quantum AI models.
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