Coagulo-Net: Enhancing the mathematical modeling of blood coagulation using physics-informed neural networks

IF 6 1区 计算机科学 Q1 COMPUTER SCIENCE, ARTIFICIAL INTELLIGENCE Neural Networks Pub Date : 2024-09-19 DOI:10.1016/j.neunet.2024.106732
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Abstract

Blood coagulation, which involves a group of complex biochemical reactions, is a crucial step in hemostasis to stop bleeding at the injury site of a blood vessel. Coagulation abnormalities, such as hypercoagulation and hypocoagulation, could either cause thrombosis or hemorrhage, resulting in severe clinical consequences. Mathematical models of blood coagulation have been widely used to improve the understanding of the pathophysiology of coagulation disorders, guide the design and testing of new anticoagulants or other therapeutic agents, and promote precision medicine. However, estimating the parameters in these coagulation models has been challenging as not all reaction rate constants and new parameters derived from model assumptions are measurable. Although various conventional methods have been employed for parameter estimation for coagulation models, the existing approaches have several shortcomings. Inspired by the physics-informed neural networks, we propose Coagulo-Net, which synergizes the strengths of deep neural networks with the mechanistic understanding of the blood coagulation processes to enhance the mathematical models of the blood coagulation cascade. We assess the performance of the Coagulo-Net using two existing coagulation models with different extents of complexity. Our simulation results illustrate that Coagulo-Net can efficiently infer the unknown model parameters and dynamics of species based on sparse measurement data and data contaminated with noise. In addition, we show that Coagulo-Net can process a mixture of synthetic and experimental data and refine the predictions of existing mathematical models of coagulation. These results demonstrate the promise of Coagulo-Net in enhancing current coagulation models and aiding the creation of novel models for physiological and pathological research. These results showcase the potential of Coagulo-Net to advance computational modeling in the study of blood coagulation, improving both research methodologies and the development of new therapies for treating patients with coagulation disorders.

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凝血网络:利用物理信息神经网络加强血液凝固的数学建模
血液凝固涉及一系列复杂的生化反应,是血管损伤部位止血的关键步骤。凝血异常,如高凝和低凝,可导致血栓形成或大出血,造成严重的临床后果。血液凝固数学模型已被广泛应用于提高对凝血障碍病理生理学的认识、指导新型抗凝剂或其他治疗药物的设计和测试,以及促进精准医疗的发展。然而,估算这些凝血模型中的参数一直是一项挑战,因为并非所有反应速率常数和从模型假设中得出的新参数都是可测量的。虽然已有多种传统方法用于凝血模型的参数估计,但现有方法存在一些缺陷。受物理信息神经网络的启发,我们提出了 Coagulo-Net,它将深度神经网络的优势与对血液凝固过程的机理理解相结合,以增强血液凝固级联的数学模型。我们使用两个复杂程度不同的现有凝血模型评估了 Coagulo-Net 的性能。我们的模拟结果表明,Coagulo-Net 可以根据稀疏的测量数据和受噪声污染的数据有效地推断未知的模型参数和物种动态。此外,我们还证明 Coagulo-Net 可以处理合成数据和实验数据的混合物,并完善现有凝结数学模型的预测。这些结果表明,Coagulo-Net 有希望增强现有的凝血模型,并帮助创建用于生理和病理研究的新型模型。这些结果展示了 Coagulo-Net 在推进血液凝固研究中的计算建模、改进研究方法和开发治疗凝血障碍患者的新疗法方面的潜力。
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来源期刊
Neural Networks
Neural Networks 工程技术-计算机:人工智能
CiteScore
13.90
自引率
7.70%
发文量
425
审稿时长
67 days
期刊介绍: Neural Networks is a platform that aims to foster an international community of scholars and practitioners interested in neural networks, deep learning, and other approaches to artificial intelligence and machine learning. Our journal invites submissions covering various aspects of neural networks research, from computational neuroscience and cognitive modeling to mathematical analyses and engineering applications. By providing a forum for interdisciplinary discussions between biology and technology, we aim to encourage the development of biologically-inspired artificial intelligence.
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