OpenRaiser/Intern-Atlas huggingface dataset:
Physics-Guided Foundation Model for Scientific Discovery: An Application to Aquatic Science
Venue: Conference AAAI 2025
Year: 2025

Physics-guided machine learning (PGML) has become a prevalent approach in studying scientific systems due to its ability to integrate scientific theories for enhancing machine learning (ML) models. However, most PGML approaches are tailored to isolated and relatively simple tasks, which limits their applicability to complex systems involving multiple interacting processes and numerous influencing features. In this paper, we propose a \textit{\textbf{P}hysics-\textbf{G}uided \textbf{F}oundation \textbf{M}odel (\textbf{PGFM})} that combines pre-trained ML models and physics-based models and leverages their complementary strengths to improve the modeling of multiple coupled processes. To effectively conduct pre-training, we construct a simulated environmental system that encompasses a wide range of influencing features and various simulated variables generated by physics-based models. The model is pre-trained in this system to adaptively select important feature interactions guided by multi-task objectives. We then fine-tune the model for each specific task using true observations, while maintaining consistency with established physical theories, such as the principles of mass and energy conservation. We demonstrate the effectiveness of this methodology in modeling water temperature and dissolved oxygen dynamics in real-world lakes. The proposed PGFM is also broadly applicable to a range of scientific fields where physics-based models are being used.
FSTA-SNN: Frequency-Based Spatial-Temporal Attention Module for Spiking Neural Networks
Venue: Conference AAAI 2025
Year: 2025

Spiking Neural Networks (SNNs) are emerging as a promising alternative to Artificial Neural Networks (ANNs) due to their inherent energy efficiency. Owing to the inherent sparsity in spike generation within SNNs, the in-depth analysis and optimization of intermediate output spikes are often neglected. This oversight significantly restricts the inherent energy efficiency of SNNs and diminishes their advantages in spatiotemporal feature extraction, resulting in a lack of accuracy and unnecessary energy expenditure. In this work, we analyze the inherent spiking characteristics of SNNs from both temporal and spatial perspectives. In terms of spatial analysis, we find that shallow layers tend to focus on learning vertical variations, while deeper layers gradually learn horizontal variations of features. Regarding temporal analysis, we observe that there is not a significant difference in feature learning across different time steps. This suggests that increasing the time steps has limited effect on feature learning. Based on the insights derived from these analyses, we propose a Frequency-based Spatial-Temporal Attention (FSTA) module to enhance feature learning in SNNs. This module aims to improve the feature learning capabilities by suppressing redundant spike features.The experimental results indicate that the introduction of the FSTA module significantly reduces the spike firing rate of SNNs, demonstrating superior performance compared to state-of-the-art baselines across multiple datasets.
Improving Natural Language Understanding for LLMs via Large-Scale Instruction Synthesis
Venue: Conference AAAI 2025
Year: 2025

High-quality, large-scale instructions are crucial for aligning large language models (LLMs), however, there is a severe shortage of instruction in the field of natural language understanding (NLU). Previous works on constructing NLU instructions mainly focus on information extraction (IE), neglecting tasks such as machine reading comprehension, question answering, and text classification. Furthermore, the lack of diversity in the data has led to a decreased generalization ability of trained LLMs in other NLU tasks and a noticeable decline in the fundamental model's general capabilities. To address this issue, we propose Hum, a large-scale, high-quality synthetic instruction corpus for NLU tasks, designed to enhance the NLU capabilities of LLMs. Specifically, Hum includes IE (either close IE or open IE), machine reading comprehension, text classification, and instruction generalist tasks, thereby enriching task diversity. Additionally, we introduce a human-LLMs collaborative mechanism to synthesize instructions, which enriches instruction diversity by incorporating guidelines, preference rules, and format variants. We conduct extensive experiments on 5 NLU tasks and 28 general capability evaluation datasets for LLMs. Experimental results show that Hum enhances the NLU capabilities of six LLMs by an average of 3.1\%, with no significant decline observed in other general capabilities.
Knowledge Graph Completion with Relation-Aware Anchor Enhancement
Venue: Conference AAAI 2025
Year: 2025

Text-based knowledge graph completion methods take advantage of pre-trained language models (PLM) to enhance intrinsic semantic connections of raw triplets with detailed text descriptions. Typical methods in this branch map an input query (textual descriptions associated with an entity and a relation) and its candidate entities into feature vectors, respectively, and then maximize the probability of valid triples. These methods are gaining promising performance and increasing attention for the rapid development of large language models. According to the property of the language models, the more related and specific context information the input query provides, the more discriminative the resultant embedding will be. In this paper, through observation and validation, we find a neglected fact that the relation-aware neighbors of the head entities in queries could act as effective contexts for more precise link prediction. Driven by this finding, we propose a relation-aware anchor enhanced knowledge graph completion method (RAA-KGC). Specifically, in our method, to provide a reference of what might the target entity be like, we first generate anchor entities within the relation-aware neighborhood of the head entity. Then, by pulling the query embedding towards the neighborhoods of the anchors, it is tuned to be more discriminative for target entity matching. The results of our extensive experiments not only validate the efficacy of RAA-KGC but also reveal that by integrating our relation-aware anchor enhancement strategy, the performance of current leading methods can be notably enhanced without substantial modifications.
Synergistic Multi-Agent Framework with Trajectory Learning for Knowledge-Intensive Tasks
Venue: Conference AAAI 2025
Year: 2025

Recent advancements in Large Language Models (LLMs) have led to significant breakthroughs in various natural language processing tasks. However, generating factually consistent responses in knowledge-intensive scenarios remains a challenge due to issues such as hallucination, difficulty in acquiring long-tailed knowledge, and limited memory expansion. This paper introduces SMART, a novel multi-agent framework that leverages external knowledge to enhance the interpretability and factual consistency of LLM-generated responses. SMART comprises four specialized agents, each performing a specific sub-trajectory action to navigate complex knowledge-intensive tasks. We propose a multi-agent co-training paradigm, Long-Short Trajectory Learning, which ensures synergistic collaboration among agents while maintaining fine-grained execution by each agent. Extensive experiments on five knowledge-intensive tasks demonstrate SMART's superior performance compared to widely adopted knowledge internalization and knowledge enhancement methods. Our framework can extend beyond knowledge-intensive tasks to more complex scenarios. Our code is available at https://github.com/yueshengbin/SMART.
Rethinking Cancer Gene Identification Through Graph Anomaly Analysis
Venue: Conference AAAI 2025
Year: 2025

Graph neural networks (GNNs) have shown promise in integrating protein-protein interaction (PPI) networks for identifying cancer genes in recent studies. However, due to the insufficient modeling of the biological information in PPI networks, more faithfully depiction of complex protein interaction patterns for cancer genes within the graph structure remains largely unexplored. This study takes a pioneering step toward bridging biological anomalies in protein interactions caused by cancer genes to statistical graph anomaly. We find a unique graph anomaly exhibited by cancer genes, namely weight heterogeneity, which manifests as significantly higher variance in edge weights of cancer gene nodes within the graph. Additionally, from the spectral perspective, we demonstrate that the weight heterogeneity could lead to the "flattening out" of spectral energy, with a concentration towards the extremes of the spectrum. Building on these insights, we propose the HIerarchical-Perspective Graph Neural Network (HIPGNN) that not only determines spectral energy distribution variations on the spectral perspective, but also perceives detailed protein interaction context on the spatial perspective. Extensive experiments are conducted on two reprocessed datasets STRINGdb and CPDB, and the experimental results demonstrate the superiority of HIPGNN.
Online Guidance Graph Optimization for Lifelong Multi-Agent Path Finding
Venue: Conference AAAI 2025
Year: 2025

We study the problem of optimizing a guidance policy capable of dynamically guiding the agents for lifelong Multi-Agent Path Finding based on real-time traffic patterns. Multi-Agent Path Finding (MAPF) focuses on moving multiple agents from their starts to goals without collisions. Its lifelong variant, LMAPF, continuously assigns new goals to agents. In this work, we focus on improving the solution quality of PIBT, a state-of-the-art rule-based LMAPF algorithm, by optimizing a policy to generate adaptive guidance. We design two pipelines to incorporate guidance in PIBT in two different ways. We demonstrate the superiority of the optimized policy over both static guidance and human-designed policies. Additionally, we explore scenarios where task distribution changes over time, a challenging yet common situation in real-world applications that is rarely explored in the literature.
Graph Structure Refinement with Energy-based Contrastive Learning
Venue: Conference AAAI 2025
Year: 2025

Graph Neural Networks (GNNs) have recently gained widespread attention as a successful tool for analyzing graph-structured data. However, imperfect graph structure with noisy links lacks enough robustness and may damage graph representations, therefore limiting the GNNs' performance in practical tasks. Moreover, existing generative architectures fail to fit discriminative graph-related tasks. To tackle these issues, we introduce an unsupervised method based on a joint of generative training and discriminative training to learn graph structure and representation, aiming to improve the discriminative performance of generative models. We propose an Energy-based Contrastive Learning (ECL) guided Graph Structure Refinement (GSR) framework, denoted as ECL-GSR. To our knowledge, this is the first work to combine energy-based models with contrastive learning for GSR. Specifically, we leverage ECL to approximate the joint distribution of sample pairs, which increases the similarity between representations of positive pairs while reducing the similarity between negative ones. Refined structure is produced by augmenting and removing edges according to the similarity metrics among node representations. Extensive experiments demonstrate that ECL-GSR outperforms the state-of-the-art on eight benchmark datasets in node classification. ECL-GSR achieves faster training with fewer samples and memories against the leading baseline, highlighting its simplicity and efficiency in downstream tasks.
ABQ-LLM: Arbitrary-Bit Quantized Inference Acceleration for Large Language Models
Venue: Conference AAAI 2025
Year: 2025

Large Language Models (LLMs) have revolutionized natural language processing tasks. However, their practical application is constrained by substantial memory and computational demands. Post-training quantization (PTQ) is considered an effective method to accelerate LLM inference. Despite its growing popularity in LLM model compression, PTQ deployment faces two major challenges. First, low-bit quantization leads to performance degradation. Second, restricted by the limited integer computing unit type on GPUs, quantized matrix operations with different precisions cannot be effectively accelerated. To address these issues, we introduce a novel arbitrary-bit quantization algorithm and inference framework, ABQ-LLM. It achieves superior performance across various quantization settings and enables efficient arbitrary-precision quantized inference on the GPU. ABQ-LLM introduces several key innovations: (1) a distribution correction method for transformer blocks to mitigate distribution differences caused by full quantization of weights and activations, improving performance at low bit-widths. (2) the bit balance strategy to counteract performance degradation from asymmetric distribution issues at very low bit-widths (e.g., 2-bit). (3) an innovative quantization acceleration framework that reconstructs the quantization matrix multiplication of arbitrary precision combinations based on BTC (Binary TensorCore) equivalents, gets rid of the limitations of INT4/INT8 computing units. ABQ-LLM can convert each component bit width gain into actual acceleration gain, maximizing performance under mixed precision(e.g., W6A6, W2A8). Based on W2*A8 quantization configuration on LLaMA-7B model, it achieved a WikiText2 perplexity of 7.59 (2.17$\downarrow $ vs 9.76 in AffineQuant). Compared to SmoothQuant, we realized 1.6$\times$ acceleration improvement and 2.7$\times$ memory compression gain.
Frequency-Aware Density Control via Reparameterization for High-Quality Rendering of 3D Gaussian Splatting
Venue: Conference AAAI 2025
Year: 2025

By adaptively controlling the density and generating more Gaussians in regions with high-frequency information, 3D Gaussian Splatting (3DGS) can better represent scene details. From the signal processing perspective, representing details usually needs more Gaussians with relatively smaller scales. However, 3DGS currently lacks an explicit constraint linking the density and scale of 3D Gaussians across the domain, leading to 3DGS using improper-scale Gaussians to express frequency information, resulting in the loss of accuracy. In this paper, we propose to establish a direct relation between density and scale through the reparameterization of the scaling parameters and ensure the consistency between them via explicit constraints (i.e., density responds well to changes in frequency). Furthermore, we develop a frequency-aware density control strategy, consisting of densification and deletion, to improve representation quality with fewer Gaussians. A dynamic threshold encourages densification in high-frequency regions, while a scale-based filter deletes Gaussians with improper scale. Experimental results on various datasets demonstrate that our method outperforms existing state-of-the-art methods quantitatively and qualitatively.
World Knowledge-Enhanced Reasoning Using Instruction-Guided Interactor in Autonomous Driving
Venue: Conference AAAI 2025
Year: 2025

The Multi-modal Large Language Models (MLLMs) with extensive world knowledge have revitalized autonomous driving, particularly in reasoning tasks within perceivable regions. However, when faced with perception-limited areas (dynamic or static occlusion regions), MLLMs struggle to effectively integrate perception ability with world knowledge for reasoning. These perception-limited regions can conceal crucial safety information, especially for vulnerable road users. In this paper, we propose a framework, which aims to improve autonomous driving performance under perceptionlimited conditions by enhancing the integration of perception capabilities and world knowledge. Specifically, we propose a plug-and-play instruction-guided interaction module that bridges modality gaps and significantly reduces the input sequence length, allowing it to adapt effectively to multi-view video inputs. Furthermore, to better integrate world knowledge with driving-related tasks, we have collected and refined a large-scale multi-modal dataset that includes 2 million natural language QA pairs, 1.7 million grounding task data. To evaluate the model's utilization of world knowledge, we introduce an object-level risk assessment dataset comprising 200K QA pairs, where the questions necessitate multi-step reasoning leveraging world knowledge for resolution. Extensive experiments validate the effectiveness of our proposed method.
Blend the Separated: Mixture of Synergistic Experts for Data-Scarcity Drug-Target Interaction Prediction
Venue: Conference AAAI 2025
Year: 2025

Drug-target interaction prediction (DTI) is essential in various applications including drug discovery and clinical application. There are two perspectives of input data widely used in DTI prediction: Intrinsic data represents how drugs or targets are constructed, and extrinsic data represents how drugs or targets are related to other biological entities. However, any of the two perspectives of input data can be scarce for some drugs or targets, especially for those unpopular or newly discovered. Furthermore, ground-truth labels for specific interaction types can also be scarce. Therefore, we propose the first method to tackle DTI prediction under input data and/or label scarcity. To make our model functional when only one perspective of input data is available, we design two separate experts to process intrinsic and extrinsic data respectively and fuse them adaptively according to different samples. Furthermore, to make the two perspectives complement each other and remedy label scarcity, two experts synergize with each other in a mutually supervised way to exploit the enormous unlabeled data. Extensive experiments on 3 real-world datasets under different extents of input data scarcity and/or label scarcity demonstrate our model outperforms states of the art significantly and steadily, with a maximum improvement of 53.53%. We also test our model without any data scarcity and it still outperforms current methods.
Bootstraping Clustering of Gaussians for View-consistent 3D Scene Understanding
Venue: Conference AAAI 2025
Year: 2025

Injecting semantics into 3D Gaussian Splatting (3DGS) has recently garnered significant attention. While current approaches typically distill 3D semantic features from 2D foundational models (e.g., CLIP and SAM) to facilitate novel view segmentation and semantic understanding, their heavy reliance on 2D supervision can undermine cross-view semantic consistency and necessitate complex data preparation processes, therefore hindering view-consistent scene understanding. In this work, we present FreeGS, an unsupervised semantic-embedded 3DGS framework that achieves view-consistent 3D scene understanding without the need for 2D labels. Instead of directly learning semantic features, we introduce the IDentity-coupled Semantic Field (IDSF) into 3DGS, which captures both semantic representations and view-consistent instance indices for each Gaussian. We optimize IDSF with a two-step alternating strategy: semantics help to extract coherent instances in 3D space, while the resulting instances regularize the injection of stable semantics from 2D space. Additionally, we adopt a 2D-3D joint contrastive loss to enhance the complementarity between view-consistent 3D geometry and rich semantics during the bootstrapping process, enabling FreeGS to uniformly perform tasks such as novel-view semantic segmentation, object selection, and 3D object detection. Extensive experiments on LERF-Mask, 3D-OVS, and ScanNet datasets demonstrate that FreeGS performs comparably to state-of-the-art methods while avoiding the complex data preprocessing workload. Our code is publicly available at https://github.com/wb014/FreeGS.
Efficient Traffic Prediction Through Spatio-Temporal Distillation
Venue: Conference AAAI 2025
Year: 2025

Graph neural networks (GNNs) have gained considerable attention in recent years for traffic flow prediction due to their ability to learn spatio-temporal pattern representations through a graph-based message-passing framework. Although GNNs have shown great promise in handling traffic datasets, their deployment in real-life applications has been hindered by scalability constraints arising from high-order message passing. Additionally, the over-smoothing problem of GNNs may lead to indistinguishable region representations as the number of layers increases, resulting in performance degradation. To address these challenges, we propose a new knowledge distillation paradigm termed LightST that transfers spatial and temporal knowledge from a high-capacity teacher to a lightweight student. Specifically, we introduce a spatio-temporal knowledge distillation framework that helps student MLPs capture graph-structured global spatio-temporal patterns while alleviating the over-smoothing effect with adaptive knowledge distillation. Extensive experiments verify that LightST significantly speeds up traffic flow predictions by 5X to 40X compared to state-of-the-art spatio-temporal GNNs, all while maintaining superior accuracy.
Pose Magic: Efficient and Temporally Consistent Human Pose Estimation with a Hybrid Mamba-GCN Network
Venue: Conference AAAI 2025
Year: 2025

Current state-of-the-art (SOTA) methods in 3D Human Pose Estimation (HPE) are primarily based on Transformers. However, existing Transformer-based 3D HPE backbones often encounter a trade-off between accuracy and computational efficiency. To resolve the above dilemma, in this work, we leverage recent advances in state space models and utilize Mamba for high-quality and efficient long-range modeling. Nonetheless, Mamba still faces challenges in precisely exploiting local dependencies between joints. To address these issues, we propose a new attention-free hybrid spatiotemporal architecture named Hybrid Mamba-GCN (Pose Magic). This architecture introduces local enhancement with GCN by capturing relationships between neighboring joints, thus producing new representations to complement Mamba's outputs. By adaptively fusing representations from Mamba and GCN, Pose Magic demonstrates superior capability in learning the underlying 3D structure. To meet the requirements of real-time inference, we also provide a fully causal version. Extensive experiments show that Pose Magic achieves new SOTA results ($\downarrow 0.9 mm$) while saving $74.1\%$ FLOPs. In addition, Pose Magic exhibits optimal motion consistency and the ability to generalize to unseen sequence lengths.
EDENet: Echo Direction Encoding Network for Place Recognition Based on Ground Penetrating Radar
Venue: Conference AAAI 2025
Year: 2025

Ground penetrating radar (GPR) based localization has gained significant recognition in robotics due to its ability to detect stable subsurface features, offering advantages in environments where traditional sensors like cameras and LiDAR may struggle. However, existing methods are primarily focused on small-scale place recognition (PR), leaving the challenges of PR in large-scale maps unaddressed. These challenges include the inherent sparsity of underground features and the variability in underground dielectric constants, which complicate robust localization. In this work, we investigate the geometric relationship between GPR echo sequences and underground scenes, leveraging the robustness of directional features to inform our network design. We introduce learnable Gabor filters for the precise extraction of directional responses, coupled with a direction-aware attention mechanism for effective geometric encoding. To further enhance performance, we incorporate a shift-invariant unit and a multi-scale aggregation strategy to better accommodate variations in di-electric constants. Experiments conducted on public datasets demonstrate that our proposed EDENet not only surpasses existing solutions in terms of PR performance but also offers advantages in model size and computational efficiency.