Victor




Abstract:Recent progress in Graph Neural Networks (GNNs) has greatly enhanced the ability to model complex molecular structures for predicting properties. Nevertheless, molecular data encompasses more than just graph structures, including textual and visual information that GNNs do not handle well. To bridge this gap, we present an innovative framework that utilizes multimodal molecular data to extract insights from Large Language Models (LLMs). We introduce GALLON (Graph Learning from Large Language Model Distillation), a framework that synergizes the capabilities of LLMs and GNNs by distilling multimodal knowledge into a unified Multilayer Perceptron (MLP). This method integrates the rich textual and visual data of molecules with the structural analysis power of GNNs. Extensive experiments reveal that our distilled MLP model notably improves the accuracy and efficiency of molecular property predictions.




Abstract:Medical time series data, such as Electroencephalography (EEG) and Electrocardiography (ECG), play a crucial role in healthcare, such as diagnosing brain and heart diseases. Existing methods for medical time series classification primarily rely on handcrafted biomarkers extraction and CNN-based models, with limited exploration of transformers tailored for medical time series. In this paper, we introduce Medformer, a multi-granularity patching transformer tailored specifically for medical time series classification. Our method incorporates three novel mechanisms to leverage the unique characteristics of medical time series: cross-channel patching to leverage inter-channel correlations, multi-granularity embedding for capturing features at different scales, and two-stage (intra- and inter-granularity) multi-granularity self-attention for learning features and correlations within and among granularities. We conduct extensive experiments on five public datasets under both subject-dependent and challenging subject-independent setups. Results demonstrate Medformer's superiority over 10 baselines, achieving top averaged ranking across five datasets on all six evaluation metrics. These findings underscore the significant impact of our method on healthcare applications, such as diagnosing Myocardial Infarction, Alzheimer's, and Parkinson's disease. We release the source code at \url{https://github.com/DL4mHealth/Medformer}.
Abstract:Normalization techniques are crucial for enhancing Transformer models' performance and stability in time series analysis tasks, yet traditional methods like batch and layer normalization often lead to issues such as token shift, attention shift, and sparse attention. We propose UnitNorm, a novel approach that scales input vectors by their norms and modulates attention patterns, effectively circumventing these challenges. Grounded in existing normalization frameworks, UnitNorm's effectiveness is demonstrated across diverse time series analysis tasks, including forecasting, classification, and anomaly detection, via a rigorous evaluation on 6 state-of-the-art models and 10 datasets. Notably, UnitNorm shows superior performance, especially in scenarios requiring robust attention mechanisms and contextual comprehension, evidenced by significant improvements by up to a 1.46 decrease in MSE for forecasting, and a 4.89% increase in accuracy for classification. This work not only calls for a reevaluation of normalization strategies in time series Transformers but also sets a new direction for enhancing model performance and stability. The source code is available at https://anonymous.4open.science/r/UnitNorm-5B84.
Abstract:This paper presents a new tool learning dataset Seal-Tools, which contains self-instruct API-like tools. Seal-Tools not only offers a large number of tools, but also includes instances which demonstrate the practical application of tools. Seeking to generate data on a large scale while ensuring reliability, we propose a self-instruct method to generate tools and instances, allowing precise control over the process. Moreover, our Seal-Tools contains hard instances that call multiple tools to complete the job, among which some are nested tool callings. For precise and comprehensive evaluation, we use strict format control and design three metrics from different dimensions. Therefore, Seal-Tools can serve as a new benchmark to evaluate the tool-calling ability of LLMs. Finally, we evaluate several prevalent LLMs and our finetuned model on Seal-Tools. The results show that current systems are far from perfect. The code, data and experiment results are available at https://github.com/fairyshine/Seal-Tools .




Abstract:Super-resolution from motion-blurred images poses a significant challenge due to the combined effects of motion blur and low spatial resolution. To address this challenge, this paper introduces an Event-based Blurry Super Resolution Network (EBSR-Net), which leverages the high temporal resolution of events to mitigate motion blur and improve high-resolution image prediction. Specifically, we propose a multi-scale center-surround event representation to fully capture motion and texture information inherent in events. Additionally, we design a symmetric cross-modal attention module to fully exploit the complementarity between blurry images and events. Furthermore, we introduce an intermodal residual group composed of several residual dense Swin Transformer blocks, each incorporating multiple Swin Transformer layers and a residual connection, to extract global context and facilitate inter-block feature aggregation. Extensive experiments show that our method compares favorably against state-of-the-art approaches and achieves remarkable performance.




Abstract:Large Language Models (LLMs) can automate or substitute different types of tasks in the software engineering process. This study evaluates the resource utilization and accuracy of LLM in interpreting and executing natural language queries against traditional SQL within relational database management systems. We empirically examine the resource utilization and accuracy of nine LLMs varying from 7 to 34 Billion parameters, including Llama2 7B, Llama2 13B, Mistral, Mixtral, Optimus-7B, SUS-chat-34B, platypus-yi-34b, NeuralHermes-2.5-Mistral-7B and Starling-LM-7B-alpha, using a small transaction dataset. Our findings indicate that using LLMs for database queries incurs significant energy overhead (even small and quantized models), making it an environmentally unfriendly approach. Therefore, we advise against replacing relational databases with LLMs due to their substantial resource utilization.
Abstract:We consider the problem of deep fair clustering, which partitions data into clusters via the representations extracted by deep neural networks while hiding sensitive data attributes. To achieve fairness, existing methods present a variety of fairness-related objective functions based on the group fairness criterion. However, these works typically assume that the sensitive attributes are discrete and do not work for continuous sensitive variables, such as the proportion of the female population in an area. Besides, the potential of the representations learned from clustering tasks to improve performance on other tasks is ignored by existing works. In light of these limitations, we propose a flexible deep fair clustering method that can handle discrete and continuous sensitive attributes simultaneously. Specifically, we design an information bottleneck style objective function to learn fair and clustering-friendly representations. Furthermore, we explore for the first time the transferability of the extracted representations to other downstream tasks. Unlike existing works, we impose fairness at the representation level, which could guarantee fairness for the transferred task regardless of clustering results. To verify the effectiveness of the proposed method, we perform extensive experiments on datasets with discrete and continuous sensitive attributes, demonstrating the advantage of our method in comparison with state-of-the-art methods.




Abstract:Most research on deformable linear object (DLO) manipulation assumes rigid grasping. However, beyond rigid grasping and re-grasping, in-hand following is also an essential skill that humans use to dexterously manipulate DLOs, which requires continuously changing the grasp point by in-hand sliding while holding the DLO to prevent it from falling. Achieving such a skill is very challenging for robots without using specially designed but not versatile end-effectors. Previous works have attempted using generic parallel grippers, but their robustness is unsatisfactory owing to the conflict between following and holding, which is hard to balance with a one-degree-of-freedom gripper. In this work, inspired by how humans use fingers to follow DLOs, we explore the usage of a generic dexterous hand with tactile sensing to imitate human skills and achieve robust in-hand DLO following. To enable the hardware system to function in the real world, we develop a framework that includes Cartesian-space arm-hand control, tactile-based in-hand 3-D DLO pose estimation, and task-specific motion design. Experimental results demonstrate the significant superiority of our method over using parallel grippers, as well as its great robustness, generalizability, and efficiency.
Abstract:Self-supervised learning (SSL) has recently emerged as a powerful approach to learning representations from large-scale unlabeled data, showing promising results in time series analysis. The self-supervised representation learning can be categorized into two mainstream: contrastive and generative. In this paper, we will present a comprehensive comparative study between contrastive and generative methods in time series. We first introduce the basic frameworks for contrastive and generative SSL, respectively, and discuss how to obtain the supervision signal that guides the model optimization. We then implement classical algorithms (SimCLR vs. MAE) for each type and conduct a comparative analysis in fair settings. Our results provide insights into the strengths and weaknesses of each approach and offer practical recommendations for choosing suitable SSL methods. We also discuss the implications of our findings for the broader field of representation learning and propose future research directions. All the code and data are released at \url{https://github.com/DL4mHealth/SSL_Comparison}.




Abstract:We present Bayesian Diffusion Models (BDM), a prediction algorithm that performs effective Bayesian inference by tightly coupling the top-down (prior) information with the bottom-up (data-driven) procedure via joint diffusion processes. We show the effectiveness of BDM on the 3D shape reconstruction task. Compared to prototypical deep learning data-driven approaches trained on paired (supervised) data-labels (e.g. image-point clouds) datasets, our BDM brings in rich prior information from standalone labels (e.g. point clouds) to improve the bottom-up 3D reconstruction. As opposed to the standard Bayesian frameworks where explicit prior and likelihood are required for the inference, BDM performs seamless information fusion via coupled diffusion processes with learned gradient computation networks. The specialty of our BDM lies in its capability to engage the active and effective information exchange and fusion of the top-down and bottom-up processes where each itself is a diffusion process. We demonstrate state-of-the-art results on both synthetic and real-world benchmarks for 3D shape reconstruction.