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Zhengchun Liu

Publications and source records attributed to Zhengchun Liu.

At least 19 recordsLinked to original sources

PBench: Workload Synthesizer with Real Statistics for Cloud Analytics Benchmarking

Cloud service providers commonly use standard benchmarks like TPC-H and TPC-DS to evaluate and optimize cloud data analytics systems. However, these benchmarks rely on fixed query patterns and fail to capture the real execution statistics of production cloud workloads. Although some cloud database vendors have recently released real workload traces, these traces alone do not qualify as benchmarks, as they typically lack essential components like the original SQL queries and their underlying databases. To overcome this limitation, this paper introduces a new problem of workload synthesis with real statistics, which aims to generate synthetic workloads that closely approximate real execution statistics, including key performance metrics and operator distributions, in real cloud workloads. To address this problem, we propose PBench, a novel workload synthesizer that constructs synthetic workloads by judiciously selecting and combining workload components (i.e., queries and databases) from existing benchmarks. This paper studies the key challenges in PBench. First, we address the challenge of balancing performance metrics and operator distributions by introducing a multi-objective optimization-based component selection method. Second, to capture the temporal dynamics of real workloads, we design a timestamp assignment method that progressively refines workload timestamps. Third, to handle the disparity between the original workload and the candidate workload, we propose a component augmentation approach that leverages large language models (LLMs) to generate additional workload components while maintaining statistical fidelity. We evaluate PBench on real cloud workload traces, demonstrating that it reduces approximation error by up to 6x compared to state-of-the-art methods.

cs.DB

MalleTrain: Deep Neural Network Training on Unfillable Supercomputer Nodes

First-come first-serve scheduling can result in substantial (up to 10%) of transiently idle nodes on supercomputers. Recognizing that such unfilled nodes are well-suited for deep neural network (DNN) training, due to the flexible nature of DNN training tasks, Liu et al. proposed that the re-scaling DNN training tasks to fit gaps in schedules be formulated as a mixed-integer linear programming (MILP) problem, and demonstrated via simulation the potential benefits of the approach. Here, we introduce MalleTrain, a system that provides the first practical implementation of this approach and that furthermore generalizes it by allowing it use even for DNN training applications for which model information is unknown before runtime. Key to this latter innovation is the use of a lightweight online job profiling advisor (JPA) to collect critical scalability information for DNN jobs -- information that it then employs to optimize resource allocations dynamically, in real time. We describe the MalleTrain architecture and present the results of a detailed experimental evaluation on a supercomputer GPU cluster and several representative DNN training workloads, including neural architecture search and hyperparameter optimization. Our results not only confirm the practical feasibility of leveraging idle supercomputer nodes for DNN training but improve significantly on prior results, improving training throughput by up to 22.3\% without requiring users to provide job scalability information.

cs.DC

Stage: Query Execution Time Prediction in Amazon Redshift

Query performance (e.g., execution time) prediction is a critical component of modern DBMSes. As a pioneering cloud data warehouse, Amazon Redshift relies on an accurate execution time prediction for many downstream tasks, ranging from high-level optimizations, such as automatically creating materialized views, to low-level tasks on the critical path of query execution, such as admission, scheduling, and execution resource control. Unfortunately, many existing execution time prediction techniques, including those used in Redshift, suffer from cold start issues, inaccurate estimation, and are not robust against workload/data changes. In this paper, we propose a novel hierarchical execution time predictor: the Stage predictor. The Stage predictor is designed to leverage the unique characteristics and challenges faced by Redshift. The Stage predictor consists of three model states: an execution time cache, a lightweight local model optimized for a specific DB instance with uncertainty measurement, and a complex global model that is transferable across all instances in Redshift. We design a systematic approach to use these models that best leverages optimality (cache), instance-optimization (local model), and transferable knowledge about Redshift (global model). Experimentally, we show that the Stage predictor makes more accurate and robust predictions while maintaining a practical inference latency and memory overhead. Overall, the Stage predictor can improve the average query execution latency by $20\%$ on these instances compared to the prior query performance predictor in Redshift.

cs.DB

Rapid detection of rare events from in situ X-ray diffraction data using machine learning

High-energy X-ray diffraction methods can non-destructively map the 3D microstructure and associated attributes of metallic polycrystalline engineering materials in their bulk form. These methods are often combined with external stimuli such as thermo-mechanical loading to take snapshots over time of the evolving microstructure and attributes. However, the extreme data volumes and the high costs of traditional data acquisition and reduction approaches pose a barrier to quickly extracting actionable insights and improving the temporal resolution of these snapshots. Here we present a fully automated technique capable of rapidly detecting the onset of plasticity in high-energy X-ray microscopy data. Our technique is computationally faster by at least 50 times than the traditional approaches and works for data sets that are up to 9 times sparser than a full data set. This new technique leverages self-supervised image representation learning and clustering to transform massive data into compact, semantic-rich representations of visually salient characteristics (e.g., peak shapes). These characteristics can be a rapid indicator of anomalous events such as changes in diffraction peak shapes. We anticipate that this technique will provide just-in-time actionable information to drive smarter experiments that effectively deploy multi-modal X-ray diffraction methods that span many decades of length scales.

cs.LG

FAIR principles for AI models with a practical application for accelerated high energy diffraction microscopy

A concise and measurable set of FAIR (Findable, Accessible, Interoperable and Reusable) principles for scientific data is transforming the state-of-practice for data management and stewardship, supporting and enabling discovery and innovation. Learning from this initiative, and acknowledging the impact of artificial intelligence (AI) in the practice of science and engineering, we introduce a set of practical, concise, and measurable FAIR principles for AI models. We showcase how to create and share FAIR data and AI models within a unified computational framework combining the following elements: the Advanced Photon Source at Argonne National Laboratory, the Materials Data Facility, the Data and Learning Hub for Science, and funcX, and the Argonne Leadership Computing Facility (ALCF), in particular the ThetaGPU supercomputer and the SambaNova DataScale system at the ALCF AI Testbed. We describe how this domain-agnostic computational framework may be harnessed to enable autonomous AI-driven discovery.

cs.AI

Deep learning at the edge enables real-time streaming ptychographic imaging

Coherent microscopy techniques provide an unparalleled multi-scale view of materials across scientific and technological fields, from structural materials to quantum devices, from integrated circuits to biological cells. Driven by the construction of brighter sources and high-rate detectors, coherent X-ray microscopy methods like ptychography are poised to revolutionize nanoscale materials characterization. However, associated significant increases in data and compute needs mean that conventional approaches no longer suffice for recovering sample images in real-time from high-speed coherent imaging experiments. Here, we demonstrate a workflow that leverages artificial intelligence at the edge and high-performance computing to enable real-time inversion on X-ray ptychography data streamed directly from a detector at up to 2 kHz. The proposed AI-enabled workflow eliminates the sampling constraints imposed by traditional ptychography, allowing low dose imaging using orders of magnitude less data than required by traditional methods.

cs.LG

Masked Sinogram Model with Transformer for ill-Posed Computed Tomography Reconstruction: a Preliminary Study

Computed Tomography (CT) is an imaging technique where information about an object are collected at different angles (called projections or scans). Then the cross-sectional image showing the internal structure of the slice is produced by solving an inverse problem. Limited by certain factors such as radiation dosage, projection angles, the produced images can be noisy or contain artifacts. Inspired by the success of transformer for natural language processing, the core idea of this preliminary study is to consider a projection of tomography as a word token, and the whole scan of the cross-section (A.K.A. sinogram) as a sentence in the context of natural language processing. Then we explore the idea of foundation model by training a masked sinogram model (MSM) and fine-tune MSM for various downstream applications including CT reconstruction under data collections restriction (e.g., photon-budget) and a data-driven solution to approximate solutions of the inverse problem for CT reconstruction. Models and data used in this study are available at https://github.com/lzhengchun/TomoTx.

eess.IV

Linking Scientific Instruments and HPC: Patterns, Technologies, Experiences

Powerful detectors at modern experimental facilities routinely collect data at multiple GB/s. Online analysis methods are needed to enable the collection of only interesting subsets of such massive data streams, such as by explicitly discarding some data elements or by directing instruments to relevant areas of experimental space. Such online analyses require methods for configuring and running high-performance distributed computing pipelines--what we call flows--linking instruments, HPC (e.g., for analysis, simulation, AI model training), edge computing (for analysis), data stores, metadata catalogs, and high-speed networks. In this article, we review common patterns associated with such flows and describe methods for instantiating those patterns. We also present experiences with the application of these methods to the processing of data from five different scientific instruments, each of which engages HPC resources for data inversion, machine learning model training, or other purposes. We also discuss implications of these new methods for operators and users of scientific facilities.

cs.DC

fairDMS: Rapid Model Training by Data and Model Reuse

Extracting actionable information rapidly from data produced by instruments such as the Linac Coherent Light Source (LCLS-II) and Advanced Photon Source Upgrade (APS-U) is becoming ever more challenging due to high (up to TB/s) data rates. Conventional physics-based information retrieval methods are hard-pressed to detect interesting events fast enough to enable timely focusing on a rare event or correction of an error. Machine learning~(ML) methods that learn cheap surrogate classifiers present a promising alternative, but can fail catastrophically when changes in instrument or sample result in degradation in ML performance. To overcome such difficulties, we present a new data storage and ML model training architecture designed to organize large volumes of data and models so that when model degradation is detected, prior models and/or data can be queried rapidly and a more suitable model retrieved and fine-tuned for new conditions. We show that our approach can achieve up to 100x data labelling speedup compared to the current state-of-the-art, 200x improvement in training speed, and 92x speedup in-terms of end-to-end model updating time.

cs.LG

Real-Time Streaming and Event-driven Control of Scientific Experiments

Advancements in scientific instrument sensors and connected devices provide unprecedented insight into ongoing experiments and present new opportunities for control, optimization, and steering. However, the diversity of sensors and heterogeneity of their data result in make it challenging to fully realize these new opportunities. Organizing and synthesizing diverse data streams in near-real-time requires both rich automation and Machine Learning (ML). To efficiently utilize ML during an experiment, the entire ML lifecycle must be addressed, including refining experiment configurations, retraining models, and applying decisions-tasks that require an equally diverse array of computational resources spanning centralized HPC to the accelerators at the edge. Here we present the Manufacturing Data and Machine Learning platform (MDML). The MDML is designed to standardize the research and operational environment for advanced data analytics and ML-enabled automated process optimization by providing the cyberinfrastructure to integrate sensor data streams and AI in cyber-physical systems for in-situ analysis. To achieve this, the MDML provides a fabric to receive and aggregate IoT data and simultaneously orchestrate remote computation across the computing continuum. In this paper we describe the MDML and show how it is used in advanced manufacturing to act on IoT data and orchestrate distributed ML to guide experiments.

cs.DC

Bridging Data Center AI Systems with Edge Computing for Actionable Information Retrieval

Extremely high data rates at modern synchrotron and X-ray free-electron laser light source beamlines motivate the use of machine learning methods for data reduction, feature detection, and other purposes. Regardless of the application, the basic concept is the same: data collected in early stages of an experiment, data from past similar experiments, and/or data simulated for the upcoming experiment are used to train machine learning models that, in effect, learn specific characteristics of those data; these models are then used to process subsequent data more efficiently than would general-purpose models that lack knowledge of the specific dataset or data class. Thus, a key challenge is to be able to train models with sufficient rapidity that they can be deployed and used within useful timescales. We describe here how specialized data center AI (DCAI) systems can be used for this purpose through a geographically distributed workflow. Experiments show that although there are data movement cost and service overhead to use remote DCAI systems for DNN training, the turnaround time is still less than 1/30 of using a locally deploy-able GPU.

cs.LG

Joint ptycho-tomography with deep generative priors

Joint ptycho-tomography is a powerful computational imaging framework to recover the refractive properties of a 3D object while relaxing the requirements for probe overlap that is common in conventional phase retrieval. We use an augmented Lagrangian scheme for formulating the constrained optimization problem and employ an alternating direction method of multipliers (ADMM) for the joint solution. ADMM allows the problem to be split into smaller and computationally more efficient subproblems: ptychographic phase retrieval, tomographic reconstruction, and regularization of the solution. We extend our ADMM framework with plug-and-play (PnP) denoisers by replacing the regularization subproblem with a general denoising operator based on machine learning. While the PnP framework enables integrating such learned priors as denoising operators, tuning of the denoiser prior remains challenging. To overcome this challenge, we propose a denoiser parameter to control the effect of the denoiser and to accelerate the solution. In our simulations, we demonstrate that our proposed framework with parameter tuning and learned priors generates high-quality reconstructions under limited and noisy measurement data.

eess.IV

BFTrainer: Low-Cost Training of Neural Networks on Unfillable Supercomputer Nodes

Supercomputer FCFS-based scheduling policies result in many transient idle nodes, a phenomenon that is only partially alleviated by backfill scheduling methods that promote small jobs to run before large jobs. Here we describe how to realize a novel use for these otherwise wasted resources, namely, deep neural network (DNN) training. This important workload is easily organized as many small fragments that can be configured dynamically to fit essentially any node*time hole in a supercomputer's schedule. We describe how the task of rescaling suitable DNN training tasks to fit dynamically changing holes can be formulated as a deterministic mixed integer linear programming (MILP)-based resource allocation algorithm, and show that this MILP problem can be solved efficiently at run time. We show further how this MILP problem can be adapted to optimize for administrator- or user-defined metrics. We validate our method with supercomputer scheduler logs and different DNN training scenarios, and demonstrate efficiencies of up to 93% compared with running the same training tasks on dedicated nodes. Our method thus enables substantial supercomputer resources to be allocated to DNN training with no impact on other applications.

cs.DC

BraggNN: Fast X-ray Bragg Peak Analysis Using Deep Learning

X-ray diffraction based microscopy techniques such as High Energy Diffraction Microscopy rely on knowledge of the position of diffraction peaks with high precision. These positions are typically computed by fitting the observed intensities in area detector data to a theoretical peak shape such as pseudo-Voigt. As experiments become more complex and detector technologies evolve, the computational cost of such peak detection and shape fitting becomes the biggest hurdle to the rapid analysis required for real-time feedback during in-situ experiments. To this end, we propose BraggNN, a deep learning-based method that can determine peak positions much more rapidly than conventional pseudo-Voigt peak fitting. When applied to a test dataset, BraggNN gives errors of less than 0.29 and 0.57 pixels, relative to the conventional method, for 75% and 95% of the peaks, respectively. When applied to a real experimental dataset, a 3D reconstruction that used peak positions computed by BraggNN yields 15% better results on average as compared to a reconstruction obtained using peak positions determined using conventional 2D pseudo-Voigt fitting. Recent advances in deep learning method implementations and special-purpose model inference accelerators allow BraggNN to deliver enormous performance improvements relative to the conventional method, running, for example, more than 200 times faster than a conventional method on a consumer-class GPU card with out-of-the-box software.

eess.IV

Fast and accurate learned multiresolution dynamical downscaling for precipitation

This study develops a neural network-based approach for emulating high-resolution modeled precipitation data with comparable statistical properties but at greatly reduced computational cost. The key idea is to use combination of low- and high- resolution simulations to train a neural network to map from the former to the latter. Specifically, we define two types of CNNs, one that stacks variables directly and one that encodes each variable before stacking, and we train each CNN type both with a conventional loss function, such as mean square error (MSE), and with a conditional generative adversarial network (CGAN), for a total of four CNN variants. We compare the four new CNN-derived high-resolution precipitation results with precipitation generated from original high resolution simulations, a bilinear interpolater and the state-of-the-art CNN-based super-resolution (SR) technique. Results show that the SR technique produces results similar to those of the bilinear interpolator with smoother spatial and temporal distributions and smaller data variabilities and extremes than the original high resolution simulations. While the new CNNs trained by MSE generate better results over some regions than the interpolator and SR technique do, their predictions are still not as close as the original high resolution simulations. The CNNs trained by CGAN generate more realistic and physically reasonable results, better capturing not only data variability in time and space but also extremes such as intense and long-lasting storms. The new proposed CNN-based downscaling approach can downscale precipitation from 50~km to 12~km in 14~min for 30~years once the network is trained (training takes 4~hours using 1~GPU), while the conventional dynamical downscaling would take 1~month using 600 CPU cores to generate simulations at the resolution of 12~km over contiguous United States.

cs.LG

Deep Learning-based Low-dose Tomography Reconstruction with Hybrid-dose Measurements

Synchrotron-based X-ray computed tomography is widely used for investigating inner structures of specimens at high spatial resolutions. However, potential beam damage to samples often limits the X-ray exposure during tomography experiments. Proposed strategies for eliminating beam damage also decrease reconstruction quality. Here we present a deep learning-based method to enhance low-dose tomography reconstruction via a hybrid-dose acquisition strategy composed of extremely sparse-view normal-dose projections and full-view low-dose projections. Corresponding image pairs are extracted from low-/normal-dose projections to train a deep convolutional neural network, which is then applied to enhance full-view noisy low-dose projections. Evaluation on two experimental datasets under different hybrid-dose acquisition conditions show significantly improved structural details and reduced noise levels compared to uniformly distributed acquisitions with the same number of total dosage. The resulting reconstructions also preserve more structural information than reconstructions processed with traditional analytical and regularization-based iterative reconstruction methods from uniform acquisitions. Our performance comparisons show that our implementation, HDrec, can perform denoising of a real-world experimental data 410x faster than the state-of-the-art Xlearn method while providing better quality. This framework can be applied to other tomographic or scanning based X-ray imaging techniques for enhanced analysis of dose-sensitive samples and has great potential for studying fast dynamic processes.

eess.IV

Design and Evaluation of a Simple Data Interface for Efficient Data Transfer Across Diverse Storage

Modern science and engineering computing environments often feature storage systems of different types, from parallel file systems in high-performance computing centers to object stores operated by cloud providers. To enable easy, reliable, secure, and performant data exchange among these different systems, we propose Connector, a pluggable data access architecture for diverse, distributed storage. By abstracting low-level storage system details, this abstraction permits a managed data transfer service (Globus in our case) to interact with a large and easily extended set of storage systems. Equally important, it supports third-party transfers: that is, direct data transfers from source to destination that are initiated by a third-party client but do not engage that third party in the data path. The abstraction also enables management of transfers for performance optimization, error handling, and end-to-end integrity. We present the Connector design, describe implementations for different storage services, evaluate tradeoffs inherent in managed vs.\ direct transfers, motivate recommended deployment options, and propose a performance model-based method that allows for easy characterization of performance in different contexts without exhaustive benchmarking.

cs.DC

TomoGAN: Low-Dose Synchrotron X-Ray Tomography with Generative Adversarial Networks

Synchrotron-based x-ray tomography is a noninvasive imaging technique that allows for reconstructing the internal structure of materials at high spatial resolutions from tens of micrometers to a few nanometers. In order to resolve sample features at smaller length scales, however, a higher radiation dose is required. Therefore, the limitation on the achievable resolution is set primarily by noise at these length scales. We present \TOMOGAN{}, a denoising technique based on generative adversarial networks, for improving the quality of reconstructed images for low-dose imaging conditions. We evaluate our approach in two photon-budget-limited experimental conditions: (1) sufficient number of low-dose projections (based on Nyquist sampling), and (2) insufficient or limited number of high-dose projections. In both cases the angular sampling is assumed to be isotropic, and the photon budget throughout the experiment is fixed based on the maximum allowable radiation dose on the sample. Evaluation with both simulated and experimental datasets shows that our approach can significantly reduce noise in reconstructed images, improving the structural similarity score of simulation and experimental data from 0.18 to 0.9 and from 0.18 to 0.41, respectively. Furthermore, the quality of the reconstructed images with filtered back projection followed by our denoising approach exceeds that of reconstructions with the simultaneous iterative reconstruction technique, showing the computational superiority of our approach.

cs.CV