High Performance Computing

High performance computing (HPC) encompasses a broad range of advanced computing capabilities, from single GPUs to the world’s largest supercomputers. From enabling simulation of intricate biological processes to providing real-time feedback in surgical settings and advancing machine learning applications—to name a few—HPC helps researchers explore new frontiers in medicine.
 
At the Duke Center for Computational and Digital Health Innovation, HPC serves as a foundational technology for enabling groundbreaking research and discoveries in medicine. Through state-of-the-art supercomputing resources, we unlock the potential to solve complex biological challenges and drive transformative discoveries.
 
As technology progresses, the Center continues to leverage HPC to find, track, and treat medical conditions, setting the stage for innovative and effective healthcare solutions.

How Do We Use High Performance Computing?

High performance computing is a transformative tool at the Center for Computational and Digital Health Innovation. Our researchers are driving significant advancements in medical research and clinical practice through it. A few examples follow.

Real-Time Computing for Neural Speech Prostheses

The collaborative efforts between the Viventi and Cogan Labs focus on developing advanced neural interfaces and real-time computing solutions to restore communication for patients with neurodegenerative diseases. These patients often lose the ability to speak, severely impacting their quality of life. The team addresses this challenge by utilizing high-resolution, micro-electrocorticographic (µECoG) neural recordings to capture detailed brain activity during speech production. This novel approach provides neural signals with significantly higher spatial resolution and signal-to-noise ratio compared to standard invasive recordings, resulting in nearly double the decoding accuracy.

The use of advanced computing techniques, including non-linear decoding models, leverages the rich spatio-temporal structure of these neural signals to enhance speech decoding. The real-time aspect of this research is crucial, as it enables the development of neural speech prostheses that can operate in real-time, allowing for immediate feedback and communication. Additionally, the project addresses the unique challenges of deploying these systems in environments without reliable Wi-Fi connectivity, ensuring that the technology can be used effectively in various settings. The interdisciplinary collaboration between the medical and engineering schools at Duke enhances the development and application of these cutting-edge technologies, providing new hope for patients with speech impairments.

Real-Time Computing for Neural Speech Prostheses

The collaborative efforts between the Viventi and Cogan Labs focus on developing advanced neural interfaces and real-time computing solutions to restore communication for patients with neurodegenerative diseases. These patients often lose the ability to speak, severely impacting their quality of life.

The team addresses this challenge by utilizing high-resolution, micro-electrocorticographic (µECoG) neural recordings to capture detailed brain activity during speech production. This novel approach provides neural signals with significantly higher spatial resolution and signal-to-noise ratio compared to standard invasive recordings, resulting in nearly double the decoding accuracy.

The use of advanced computing techniques, including non-linear decoding models, leverages the rich spatio-temporal structure of these neural signals to enhance speech decoding. The real-time aspect of this research is crucial, as it enables the development of neural speech prostheses that can operate in real-time, allowing for immediate feedback and communication. Additionally, the project addresses the unique challenges of deploying these systems in environments without reliable Wi-Fi connectivity, ensuring that the technology can be used effectively in various settings.

The interdisciplinary collaboration between the medical and engineering schools at Duke enhances the development and application of these cutting-edge technologies, providing new hope for patients with speech impairments.

Advancing Machine Learning in Biomedical Research

The Chatterjee Lab harnesses the power of HPC and GPUs to develop advanced machine-learning and AI models that support its protein design efforts. The lab focuses on three main areas:

  • Programmable proteome editing
  • Programmable genome editing
  • Programmable cell engineering

By leveraging GPUs, the lab can efficiently train generative language models such as Cut&CLIP, SaLT&PepPr, PepPrCLIP, and PepMLM. These models help with the design of peptide-guided therapeutics, CRISPR-mediated genome editing tools, and protocols for differentiating ovarian cell types from pluripotent stem cells.

The computational power of GPUs accelerates the lab’s ability to process large datasets and complex algorithms, facilitating rapid advancements in targeted therapeutics and genetic engineering.

Research Featuring High Performance Computing

  • Blood flow animation in human body

    Blood Flow Animation

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  • Genomic simulation

    Three Dimensional Genome Organization Regulated by Active Loop Extrusion

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  • Simulation of the mechanical response (stress) in the arterial wall; red regions indicate higher variability

    High-Fidelity Mechanistic-Probabilistic Models of Arterial Tissues

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  • Vorticity Image

    Non-Invasive Diagnostics for Coronary Artery Disease

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  • Workflow for Programmable Proteome Editing

    Generative Language Models to Design Protein Therapeutics

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  • Diagram of a coronary artery bifurcation with guidewire placement illustration

    Digital Twins for Bifurcation Lesion Treatment

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  • Use of the Adaptive Physics Refinement (APR) model within an upper body vasculature enables up to 4 orders of magnitude increase in total simulated fluid volume accessible to cellular resolution.

    Adaptive Physics Refinement

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  • Fluorescence microscopy image of a blood vessel aneurysm in red and green.

    Coupled Digital Twins as Surrogates to Assess Treatment of Cerebral Aneurysms

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  • Diagram illustrating parallel cell simulation with data exchange and ownership transfer.

    Scaling Fluid Simulations on Leadership Class Supercomputers

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Publications Featuring High Performance Computing

  • Streamline visualization of blood flow velocity within the human aortic arch, with vascular anatomy segmented from medical imaging and simulated using the HARVEY flow solver.

    Retrospective on the Lax Report: Then and Now

    More than four decades after its release, the 1982 Lax Report remains a landmark blueprint for U.S. high-performance computing (HPC) policy. This retrospective revisits…

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  • Cardiovascular Engineering and Technology cover

    Optimizing Non-invasive Fractional Flow Reserve Estimation with Machine Learning-Enhanced 1D Hemodynamic Modeling

    Patient-specific computational models exhibit strong concordance with invasively measured fractional flow reserve (FFR)—the clinical gold standard for diagnosing coronary ischemia. However, current modeling techniques…

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  • Diagram outlines a machine-learning-guided clinical workflow for revascularization.

    Real-Time Peripheral Revascularization Planning in Chronic Limb Threatening Ischemia Using HarVI: A Digital Twin Approach

    Peripheral artery disease (PAD) is a leading cause of limb loss and morbidity worldwide, with chronic limb-threatening ischemia (CLTI) representing its most severe presentation.…

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  • Diagram in wss_central_fig_v2.jpg shows vascular fluid simulation workflow.

    Investigating the Influence of Red Blood Cell Heterogeneity on Cell Transport and Blood Flow Hemodynamics

    Red blood cell distribution width (RDW), a routinely measured biomarker of red blood cell (RBC) size heterogeneity, is strongly associated with cardiovascular events, cancer…

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  • Comparison of GPU Halo Replay to its predecessor, Halo Replay.

    GPU Halo Replay: Lossless Twin Simulations for Flexible In Situ Analysis of Stencil-Based Solvers

    We introduce GPU Halo Replay, a solver-aware in situ framework for stencil-based applications that creates a lossless simulation “twin” for advanced visualization and analysis.…

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  • In situ ML pipeline integrated into the HARVEY mini app.

    Instrumenting Lightweight, Modular Machine Learning Training and Inference

    Recent advances in exascale computing have increased the resolution and fidelity of large-scale simulations, while rapid progress in deep learning has accelerated efforts to…

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  • Diagram shows vascular fluid simulation workflow.

    Multiscale Modeling of Shear-Dependent Tumor Cell Adhesion

    Circulating tumor cells (CTCs) interact with the vascular endothelium under hemodynamic forces that influence where metastatic seeding occurs. Wall shear stress (WSS) has been…

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  • Publication icon

    Parallel Adhesive Dynamics With Adaptive Physics Refinement for Large-Scale Tracking of Circulating Tumor Cells

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  • Diagram of human vasculature and digital twin modeling across biological scales.

    Digital twins and digital models of the human circulatory system

    Digital models and digital twins of human circulatory transport could transform the way cardiovascular and haematological diseases are understood, monitored and treated. Digital twins…

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  • Pre and postoperative PSV changes from baseline in a factorial sensitivity analysis.

    Real-Time Peripheral Revascularization Planning in Chronic Limb Threatening Ischemia Using HarVI: A Digital Twin Approach

    Peripheral artery disease (PAD) is a leading cause of limb loss and morbidity worldwide, with chronic limb-threatening ischemia (CLTI) representing its most severe presentation.…

    Read more