Searcharxiv⌕ Search

arXiv subjects

Ao Zhou

Publications and source records attributed to Ao Zhou.

At least 55 records · Page 3Linked to original sources

HiGraphDTI: Hierarchical Graph Representation Learning for Drug-Target Interaction Prediction

The discovery of drug-target interactions (DTIs) plays a crucial role in pharmaceutical development. The deep learning model achieves more accurate results in DTI prediction due to its ability to extract robust and expressive features from drug and target chemical structures. However, existing deep learning methods typically generate drug features via aggregating molecular atom representations, ignoring the chemical properties carried by motifs, i.e., substructures of the molecular graph. The atom-drug double-level molecular representation learning can not fully exploit structure information and fails to interpret the DTI mechanism from the motif perspective. In addition, sequential model-based target feature extraction either fuses limited contextual information or requires expensive computational resources. To tackle the above issues, we propose a hierarchical graph representation learning-based DTI prediction method (HiGraphDTI). Specifically, HiGraphDTI learns hierarchical drug representations from triple-level molecular graphs to thoroughly exploit chemical information embedded in atoms, motifs, and molecules. Then, an attentional feature fusion module incorporates information from different receptive fields to extract expressive target features.Last, the hierarchical attention mechanism identifies crucial molecular segments, which offers complementary views for interpreting interaction mechanisms. The experiment results not only demonstrate the superiority of HiGraphDTI to the state-of-the-art methods, but also confirm the practical ability of our model in interaction interpretation and new DTI discovery.

cs.LG↗

GNNavigator: Towards Adaptive Training of Graph Neural Networks via Automatic Guideline Exploration

Graph Neural Networks (GNNs) succeed significantly in many applications recently. However, balancing GNNs training runtime cost, memory consumption, and attainable accuracy for various applications is non-trivial. Previous training methodologies suffer from inferior adaptability and lack a unified training optimization solution. To address the problem, this work proposes GNNavigator, an adaptive GNN training configuration optimization framework. GNNavigator meets diverse GNN application requirements due to our unified software-hardware co-abstraction, proposed GNNs training performance model, and practical design space exploration solution. Experimental results show that GNNavigator can achieve up to 3.1x speedup and 44.9% peak memory reduction with comparable accuracy to state-of-the-art approaches.

cs.LG↗

Graph Neural Networks Automated Design and Deployment on Device-Edge Co-Inference Systems

The key to device-edge co-inference paradigm is to partition models into computation-friendly and computation-intensive parts across the device and the edge, respectively. However, for Graph Neural Networks (GNNs), we find that simply partitioning without altering their structures can hardly achieve the full potential of the co-inference paradigm due to various computational-communication overheads of GNN operations over heterogeneous devices. We present GCoDE, the first automatic framework for GNN that innovatively Co-designs the architecture search and the mapping of each operation on Device-Edge hierarchies. GCoDE abstracts the device communication process into an explicit operation and fuses the search of architecture and the operations mapping in a unified space for joint-optimization. Also, the performance-awareness approach, utilized in the constraint-based search process of GCoDE, enables effective evaluation of architecture efficiency in diverse heterogeneous systems. We implement the co-inference engine and runtime dispatcher in GCoDE to enhance the deployment efficiency. Experimental results show that GCoDE can achieve up to $44.9\times$ speedup and $98.2\%$ energy reduction compared to existing approaches across various applications and system configurations.

cs.LG↗

Multi-Label Adaptive Batch Selection by Highlighting Hard and Imbalanced Samples

Deep neural network models have demonstrated their effectiveness in classifying multi-label data from various domains. Typically, they employ a training mode that combines mini-batches with optimizers, where each sample is randomly selected with equal probability when constructing mini-batches. However, the intrinsic class imbalance in multi-label data may bias the model towards majority labels, since samples relevant to minority labels may be underrepresented in each mini-batch. Meanwhile, during the training process, we observe that instances associated with minority labels tend to induce greater losses. Existing heuristic batch selection methods, such as priority selection of samples with high contribution to the objective function, i.e., samples with high loss, have been proven to accelerate convergence while reducing the loss and test error in single-label data. However, batch selection methods have not yet been applied and validated in multi-label data. In this study, we introduce a simple yet effective adaptive batch selection algorithm tailored to multi-label deep learning models. It adaptively selects each batch by prioritizing hard samples related to minority labels. A variant of our method also takes informative label correlations into consideration. Comprehensive experiments combining five multi-label deep learning models on thirteen benchmark datasets show that our method converges faster and performs better than random batch selection.

cs.LG↗

Deciphering the Enigma of Satellite Computing with COTS Devices: Measurement and Analysis

In the wake of the rapid deployment of large-scale low-Earth orbit satellite constellations, exploiting the full computing potential of Commercial Off-The-Shelf (COTS) devices in these environments has become a pressing issue. However, understanding this problem is far from straightforward due to the inherent differences between the terrestrial infrastructure and the satellite platform in space. In this paper, we take an important step towards closing this knowledge gap by presenting the first measurement study on the thermal control, power management, and performance of COTS computing devices on satellites. Our measurements reveal that the satellite platform and COTS computing devices significantly interplay in terms of the temperature and energy, forming the main constraints on satellite computing. Further, we analyze the critical factors that shape the characteristics of onboard COTS computing devices. We provide guidelines for future research on optimizing the use of such devices for computing purposes. Finally, we have released the datasets to facilitate further study in satellite computing.

cs.NI↗

FedRDMA: Communication-Efficient Cross-Silo Federated LLM via Chunked RDMA Transmission

Communication overhead is a significant bottleneck in federated learning (FL), which has been exaggerated with the increasing size of AI models. In this paper, we propose FedRDMA, a communication-efficient cross-silo FL system that integrates RDMA into the FL communication protocol. To overcome the limitations of RDMA in wide-area networks (WANs), FedRDMA divides the updated model into chunks and designs a series of optimization techniques to improve the efficiency and robustness of RDMA-based communication. We implement FedRDMA atop the industrial federated learning framework and evaluate it on a real-world cross-silo FL scenario. The experimental results show that \sys can achieve up to 3.8$\times$ speedup in communication efficiency compared to traditional TCP/IP-based FL systems.

cs.LG↗

Energy and Time-Aware Inference Offloading for DNN-based Applications in LEO Satellites

In recent years, Low Earth Orbit (LEO) satellites have witnessed rapid development, with inference based on Deep Neural Network (DNN) models emerging as the prevailing technology for remote sensing satellite image recognition. However, the substantial computation capability and energy demands of DNN models, coupled with the instability of the satellite-ground link, pose significant challenges, burdening satellites with limited power intake and hindering the timely completion of tasks. Existing approaches, such as transmitting all images to the ground for processing or executing DNN models on the satellite, is unable to effectively address this issue. By exploiting the internal hierarchical structure of DNNs and treating each layer as an independent subtask, we propose a satellite-ground collaborative computation partial offloading approach to address this challenge. We formulate the problem of minimizing the inference task execution time and onboard energy consumption through offloading as an integer linear programming (ILP) model. The complexity in solving the problem arises from the combinatorial explosion in the discrete solution space. To address this, we have designed an improved optimization algorithm based on branch and bound. Simulation results illustrate that, compared to the existing approaches, our algorithm improve the performance by 10%-18%

cs.DC↗

Architectural Implications of GNN Aggregation Programming Abstractions

Graph neural networks (GNNs) have gained significant popularity due to the powerful capability to extract useful representations from graph data. As the need for efficient GNN computation intensifies, a variety of programming abstractions designed for optimizing GNN Aggregation have emerged to facilitate acceleration. However, there is no comprehensive evaluation and analysis upon existing abstractions, thus no clear consensus on which approach is better. In this letter, we classify existing programming abstractions for GNN Aggregation by the dimension of data organization and propagation method. By constructing these abstractions on a state-of-the-art GNN library, we perform a thorough and detailed characterization study to compare their performance and efficiency, and provide several insights on future GNN acceleration based on our analysis.

cs.LG↗

Boosting DNN Cold Inference on Edge Devices

DNNs are ubiquitous on edge devices nowadays. With its increasing importance and use cases, it's not likely to pack all DNNs into device memory and expect that each inference has been warmed up. Therefore, cold inference, the process to read, initialize, and execute a DNN model, is becoming commonplace and its performance is urgently demanded to be optimized. To this end, we present NNV12, the first on-device inference engine that optimizes for cold inference NNV12 is built atop 3 novel optimization knobs: selecting a proper kernel (implementation) for each DNN operator, bypassing the weights transformation process by caching the post-transformed weights on disk, and pipelined execution of many kernels on asymmetric processors. To tackle with the huge search space, NNV12 employs a heuristic-based scheme to obtain a near-optimal kernel scheduling plan. We fully implement a prototype of NNV12 and evaluate its performance across extensive experiments. It shows that NNV12 achieves up to 15.2x and 401.5x compared to the state-of-the-art DNN engines on edge CPUs and GPUs, respectively.

cs.LG↗

Satellite Computing: A Case Study of Cloud-Native Satellites

The on-orbit processing of massive satellite-native data relies on powerful computing power. Satellite computing has started to gain attention, with researchers proposing various algorithms, applications, and simulation testbeds. Unfortunately, a practical platform for deploying satellite computing is currently lacking. As a result, the industry needs to make relentless efforts to achieve this goal. We suggest using cloud-native technology to enhance the computing power of LEO satellites. The first main satellite of the Tiansuan constellation, BUPT-1, is a significant example of a cloud-native satellite. Prior to delving into the details of BUPT-1, we define the essential concepts of cloud-native satellites, i.e., the cloud-native load and cloud-native platform. Afterwards, we present the design scheme of cloud-native satellites, including the architecture of BUPT-1 and the experimental subjects it can support. Two validation tests are shown to reflect the operation and capability of BUPT-1. Besides, we predict possible research fields that could shape the future of satellites in the next decade.

cs.DC↗

Hardware-Aware Graph Neural Network Automated Design for Edge Computing Platforms

Graph neural networks (GNNs) have emerged as a popular strategy for handling non-Euclidean data due to their state-of-the-art performance. However, most of the current GNN model designs mainly focus on task accuracy, lacking in considering hardware resources limitation and real-time requirements of edge application scenarios. Comprehensive profiling of typical GNN models indicates that their execution characteristics are significantly affected across different computing platforms, which demands hardware awareness for efficient GNN designs. In this work, HGNAS is proposed as the first Hardware-aware Graph Neural Architecture Search framework targeting resource constraint edge devices. By decoupling the GNN paradigm, HGNAS constructs a fine-grained design space and leverages an efficient multi-stage search strategy to explore optimal architectures within a few GPU hours. Moreover, HGNAS achieves hardware awareness during the GNN architecture design by leveraging a hardware performance predictor, which could balance the GNN model accuracy and efficiency corresponding to the characteristics of targeted devices. Experimental results show that HGNAS can achieve about $10.6\times$ speedup and $88.2\%$ peak memory reduction with a negligible accuracy loss compared to DGCNN on various edge devices, including Nvidia RTX3080, Jetson TX2, Intel i7-8700K and Raspberry Pi 3B+.

cs.LG↗

From Earth to Space: A First Deployment of 5G Core Network on Satellite

Recent developments in the aerospace industry have led to a dramatic reduction in the manufacturing and launch costs of low Earth orbit satellites. The new trend enables the paradigm shift of satellite-terrestrial integrated networks with global coverage. In particular, the integration of 5G communication systems and satellites has the potential to restructure next-generation mobile networks. By leveraging the network function virtualization and network slicing, the orbital 5G core networks will facilitate the coordination and management of network functions in satellite-terrestrial integrated networks. We are the first to deploy a lightweight 5G core network on a real-world satellite to investigate its feasibility. We conducted experiments to validate the onboard 5G core network functions. The validated procedures include registration and session setup procedures. The results show that the 5G core network can function normally and generate correct signaling.

cs.NI↗

Benchmarking of DL Libraries and Models on Mobile Devices

Deploying deep learning (DL) on mobile devices has been a notable trend in recent years. To support fast inference of on-device DL, DL libraries play a critical role as algorithms and hardware do. Unfortunately, no prior work ever dives deep into the ecosystem of modern DL libs and provides quantitative results on their performance. In this paper, we first build a comprehensive benchmark that includes 6 representative DL libs and 15 diversified DL models. We then perform extensive experiments on 10 mobile devices, which help reveal a complete landscape of the current mobile DL libs ecosystem. For example, we find that the best-performing DL lib is severely fragmented across different models and hardware, and the gap between those DL libs can be rather huge. In fact, the impacts of DL libs can overwhelm the optimizations from algorithms or hardware, e.g., model quantization and GPU/DSP-based heterogeneous computing. Finally, atop the observations, we summarize practical implications to different roles in the DL lib ecosystem.

cs.LG↗

Towards Sustainable Satellite Edge Computing

Recently, Low Earth Orbit (LEO) satellites experience rapid development and satellite edge computing emerges to address the limitation of bent-pipe architecture in existing satellite systems. Introducing energy-consuming computing components in satellite edge computing increases the depth of battery discharge. This will shorten batteries' life and influences the satellites' operation in orbit. In this paper, we aim to extend batteries' life by minimizing the depth of discharge for Earth observation missions. Facing the challenges of wireless uncertainty and energy harvesting dynamics, our work develops an online energy scheduling algorithm within an online convex optimization framework. Our algorithm achieves sub-linear regret and the constraint violation asymptotically approaches zero. Simulation results show that our algorithm can reduce the depth of discharge significantly.

eess.SY↗

Tiansuan Constellation: An Open Research Platform

Satellite network is the first step of interstellar voyages. It can provide global Internet connectivity everywhere on earth, where most areas cannot access the Internet by the terrestrial infrastructure due to the geographic accessibility and high cost. The space industry experiences a rise in large low-earth-orbit satellite constellations to achieve universal connectivity. The research community is also urgent to do some leading research to bridge the connectivity divide. Researchers now conduct their work by simulation, which is far from enough. However, experiments on real satellites are blocked by the high threshold of space technology, such as deployment cost and unknown risks. To solve the above dilemma, we are eager to contribute to the universal connectivity and build an open research platform, Tiansuan constellation to support experiments on real satellite networks. We discuss the potential research topics that would benefit from Tiansuan constellation. We provide two case studies that have already deployed in two experimental satellites of Tiansuan constellation.

cs.DC↗

Optimizing Memory Efficiency of Graph Neural Networks on Edge Computing Platforms

Graph neural networks (GNN) have achieved state-of-the-art performance on various industrial tasks. However, the poor efficiency of GNN inference and frequent Out-Of-Memory (OOM) problem limit the successful application of GNN on edge computing platforms. To tackle these problems, a feature decomposition approach is proposed for memory efficiency optimization of GNN inference. The proposed approach could achieve outstanding optimization on various GNN models, covering a wide range of datasets, which speeds up the inference by up to 3x. Furthermore, the proposed feature decomposition could significantly reduce the peak memory usage (up to 5x in memory efficiency improvement) and mitigate OOM problems during GNN inference.

cs.LG↗

Hierarchical Federated Learning through LAN-WAN Orchestration

Federated learning (FL) was designed to enable mobile phones to collaboratively learn a global model without uploading their private data to a cloud server. However, exiting FL protocols has a critical communication bottleneck in a federated network coupled with privacy concerns, usually powered by a wide-area network (WAN). Such a WAN-driven FL design leads to significantly high cost and much slower model convergence. In this work, we propose an efficient FL protocol, which involves a hierarchical aggregation mechanism in the local-area network (LAN) due to its abundant bandwidth and almost negligible monetary cost than WAN. Our proposed FL can accelerate the learning process and reduce the monetary cost with frequent local aggregation in the same LAN and infrequent global aggregation on a cloud across WAN. We further design a concrete FL platform, namely LanFL, that incorporates several key techniques to handle those challenges introduced by LAN: cloud-device aggregation architecture, intra-LAN peer-to-peer (p2p) topology generation, inter-LAN bandwidth capacity heterogeneity. We evaluate LanFL on 2 typical Non-IID datasets, which reveals that LanFL can significantly accelerate FL training (1.5x-6.0x), save WAN traffic (18.3x-75.6x), and reduce monetary cost (3.8x-27.2x) while preserving the model accuracy.

cs.LG↗

DP-Net: Dynamic Programming Guided Deep Neural Network Compression

In this work, we propose an effective scheme (called DP-Net) for compressing the deep neural networks (DNNs). It includes a novel dynamic programming (DP) based algorithm to obtain the optimal solution of weight quantization and an optimization process to train a clustering-friendly DNN. Experiments showed that the DP-Net allows larger compression than the state-of-the-art counterparts while preserving accuracy. The largest 77X compression ratio on Wide ResNet is achieved by combining DP-Net with other compression techniques. Furthermore, the DP-Net is extended for compressing a robust DNN model with negligible accuracy loss. At last, a custom accelerator is designed on FPGA to speed up the inference computation with DP-Net.

cs.LG↗