pwc-archive/papers-with-abstracts huggingface dataset:
Metric-Semantic Factor Graph Generation based on Graph Neural Networks
Authors: Jose Andres Millan-Romera, Hriday Bavle, Muhammad Shaheer, Holger Voos, Jose Luis Sanchez-Lopez
Date: 2024-09-18 00:00:00
Tasks: Attribute, Edge Classification, Graph Generation

Understanding the relationships between geometric structures and semantic concepts is crucial for building accurate models of complex environments. In indoors, certain spatial constraints, such as the relative positioning of planes, remain consistent despite variations in layout. This paper explores how these invariant relationships can be captured in a graph SLAM framework by representing high-level concepts like rooms and walls, linking them to geometric elements like planes through an optimizable factor graph. Several efforts have tackled this issue with add-hoc solutions for each concept generation and with manually-defined factors. This paper proposes a novel method for metric-semantic factor graph generation which includes defining a semantic scene graph, integrating geometric information, and learning the interconnecting factors, all based on Graph Neural Networks (GNNs). An edge classification network (G-GNN) sorts the edges between planes into same room, same wall or none types. The resulting relations are clustered, generating a room or wall for each cluster. A second family of networks (F-GNN) infers the geometrical origin of the new nodes. The definition of the factors employs the same F-GNN used for the metric attribute of the generated nodes. Furthermore, share the new factor graph with the S-Graphs+ algorithm, extending its graph expressiveness and scene representation with the ultimate goal of improving the SLAM performance. The complexity of the environments is increased to N-plane rooms by training the networks on L-shaped rooms. The framework is evaluated in synthetic and simulated scenarios as no real datasets of the required complex layouts are available.
Efficacy of Synthetic Data as a Benchmark
Authors: Gaurav Maheshwari, Dmitry Ivanov, Kevin El Haddad
Date: 2024-09-18 00:00:00
Tasks: Benchmarking, Few-Shot Learning, intent-classification, Intent Classification, named-entity-recognition, Named Entity Recognition

Large language models (LLMs) have enabled a range of applications in zero-shot and few-shot learning settings, including the generation of synthetic datasets for training and testing. However, to reliably use these synthetic datasets, it is essential to understand how representative they are of real-world data. We investigate this by assessing the effectiveness of generating synthetic data through LLM and using it as a benchmark for various NLP tasks. Our experiments across six datasets, and three different tasks, show that while synthetic data can effectively capture performance of various methods for simpler tasks, such as intent classification, it falls short for more complex tasks like named entity recognition. Additionally, we propose a new metric called the bias factor, which evaluates the biases introduced when the same LLM is used to both generate benchmarking data and to perform the tasks. We find that smaller LLMs exhibit biases towards their own generated data, whereas larger models do not. Overall, our findings suggest that the effectiveness of synthetic data as a benchmark varies depending on the task, and that practitioners should rely on data generated from multiple larger models whenever possible.
Data Efficient Acoustic Scene Classification using Teacher-Informed Confusing Class Instruction
Authors: Jin Jie Sean Yeo, Ee-Leng Tan, Jisheng Bai, Santi Peksi, Woon-Seng Gan
Date: 2024-09-18 00:00:00
Tasks: Acoustic Scene Classification, Data Augmentation, Diversity, Knowledge Distillation, Scene Classification

In this technical report, we describe the SNTL-NTU team's submission for Task 1 Data-Efficient Low-Complexity Acoustic Scene Classification of the detection and classification of acoustic scenes and events (DCASE) 2024 challenge. Three systems are introduced to tackle training splits of different sizes. For small training splits, we explored reducing the complexity of the provided baseline model by reducing the number of base channels. We introduce data augmentation in the form of mixup to increase the diversity of training samples. For the larger training splits, we use FocusNet to provide confusing class information to an ensemble of multiple Patchout faSt Spectrogram Transformer (PaSST) models and baseline models trained on the original sampling rate of 44.1 kHz. We use Knowledge Distillation to distill the ensemble model to the baseline student model. Training the systems on the TAU Urban Acoustic Scene 2022 Mobile development dataset yielded the highest average testing accuracy of (62.21, 59.82, 56.81, 53.03, 47.97)% on split (100, 50, 25, 10, 5)% respectively over the three systems.
Reinforcement Learning with Lie Group Orientations for Robotics
Authors: Martin Schuck, Jan Brüdigam, Sandra Hirche, Angela Schoellig
Date: 2024-09-18 00:00:00
Tasks: reinforcement-learning, Reinforcement Learning

Handling orientations of robots and objects is a crucial aspect of many applications. Yet, ever so often, there is a lack of mathematical correctness when dealing with orientations, especially in learning pipelines involving, for example, artificial neural networks. In this paper, we investigate reinforcement learning with orientations and propose a simple modification of the network's input and output that adheres to the Lie group structure of orientations. As a result, we obtain an easy and efficient implementation that is directly usable with existing learning libraries and achieves significantly better performance than other common orientation representations. We briefly introduce Lie theory specifically for orientations in robotics to motivate and outline our approach. Subsequently, a thorough empirical evaluation of different combinations of orientation representations for states and actions demonstrates the superior performance of our proposed approach in different scenarios, including: direct orientation control, end effector orientation control, and pick-and-place tasks.
Reinforcement Learning as an Improvement Heuristic for Real-World Production Scheduling
Authors: Arthur Müller, Lukas Vollenkemper
Date: 2024-09-18 00:00:00
Tasks: Reinforcement Learning (RL), Scheduling

The integration of Reinforcement Learning (RL) with heuristic methods is an emerging trend for solving optimization problems, which leverages RL's ability to learn from the data generated during the search process. One promising approach is to train an RL agent as an improvement heuristic, starting with a suboptimal solution that is iteratively improved by applying small changes. We apply this approach to a real-world multiobjective production scheduling problem. Our approach utilizes a network architecture that includes Transformer encoding to learn the relationships between jobs. Afterwards, a probability matrix is generated from which pairs of jobs are sampled and then swapped to improve the solution. We benchmarked our approach against other heuristics using real data from our industry partner, demonstrating its superior performance.
An Explainable Machine Learning Approach to Traffic Accident Fatality Prediction
Authors: Md. Asif Khan Rifat, Ahmedul Kabir, Armana Sabiha Huq
Date: 2024-09-18 00:00:00

Road traffic accidents (RTA) pose a significant public health threat worldwide, leading to considerable loss of life and economic burdens. This is particularly acute in developing countries like Bangladesh. Building reliable models to forecast crash outcomes is crucial for implementing effective preventive measures. To aid in developing targeted safety interventions, this study presents a machine learning-based approach for classifying fatal and non-fatal road accident outcomes using data from the Dhaka metropolitan traffic crash database from 2017 to 2022. Our framework utilizes a range of machine learning classification algorithms, comprising Logistic Regression, Support Vector Machines, Naive Bayes, Random Forest, Decision Tree, Gradient Boosting, LightGBM, and Artificial Neural Network. We prioritize model interpretability by employing the SHAP (SHapley Additive exPlanations) method, which elucidates the key factors influencing accident fatality. Our results demonstrate that LightGBM outperforms other models, achieving a ROC-AUC score of 0.72. The global, local, and feature dependency analyses are conducted to acquire deeper insights into the behavior of the model. SHAP analysis reveals that casualty class, time of accident, location, vehicle type, and road type play pivotal roles in determining fatality risk. These findings offer valuable insights for policymakers and road safety practitioners in developing countries, enabling the implementation of evidence-based strategies to reduce traffic crash fatalities.
Less Memory Means smaller GPUs: Backpropagation with Compressed Activations
Authors: Daniel Barley, Holger Fröning
Date: 2024-09-18 00:00:00
Tasks: GPU

The ever-growing scale of deep neural networks (DNNs) has lead to an equally rapid growth in computational resource requirements. Many recent architectures, most prominently Large Language Models, have to be trained using supercomputers with thousands of accelerators, such as GPUs or TPUs. Next to the vast number of floating point operations the memory footprint of DNNs is also exploding. In contrast, GPU architectures are notoriously short on memory. Even comparatively small architectures like some EfficientNet variants cannot be trained on a single consumer-grade GPU at reasonable mini-batch sizes. During training, intermediate input activations have to be stored until backpropagation for gradient calculation. These make up the vast majority of the memory footprint. In this work we therefore consider compressing activation maps for the backward pass using pooling, which can reduce both the memory footprint and amount of data movement. The forward computation remains uncompressed. We empirically show convergence and study effects on feature detection at the example of the common vision architecture ResNet. With this approach we are able to reduce the peak memory consumption by 29% at the cost of a longer training schedule, while maintaining prediction accuracy compared to an uncompressed baseline.
Multi-Grid Graph Neural Networks with Self-Attention for Computational Mechanics
Authors: Paul Garnier, Jonathan Viquerat, Elie Hachem
Date: 2024-09-18 00:00:00

Advancement in finite element methods have become essential in various disciplines, and in particular for Computational Fluid Dynamics (CFD), driving research efforts for improved precision and efficiency. While Convolutional Neural Networks (CNNs) have found success in CFD by mapping meshes into images, recent attention has turned to leveraging Graph Neural Networks (GNNs) for direct mesh processing. This paper introduces a novel model merging Self-Attention with Message Passing in GNNs, achieving a 15\% reduction in RMSE on the well known flow past a cylinder benchmark. Furthermore, a dynamic mesh pruning technique based on Self-Attention is proposed, that leads to a robust GNN-based multigrid approach, also reducing RMSE by 15\%. Additionally, a new self-supervised training method based on BERT is presented, resulting in a 25\% RMSE reduction. The paper includes an ablation study and outperforms state-of-the-art models on several challenging datasets, promising advancements similar to those recently achieved in natural language and image processing. Finally, the paper introduces a dataset with meshes larger than existing ones by at least an order of magnitude. Code and Datasets will be released at https://github.com/DonsetPG/multigrid-gnn.
Secure Control Systems for Autonomous Quadrotors against Cyber-Attacks
Authors: Samuel Belkadi
Date: 2024-09-18 00:00:00
Tasks: reinforcement-learning, Reinforcement Learning, Scheduling

The problem of safety for robotic systems has been extensively studied. However, little attention has been given to security issues for three-dimensional systems, such as quadrotors. Malicious adversaries can compromise robot sensors and communication networks, causing incidents, achieving illegal objectives, or even injuring people. This study first designs an intelligent control system for autonomous quadrotors. Then, it investigates the problems of optimal false data injection attack scheduling and countermeasure design for unmanned aerial vehicles. Using a state-of-the-art deep learning-based approach, an optimal false data injection attack scheme is proposed to deteriorate a quadrotor's tracking performance with limited attack energy. Subsequently, an optimal tracking control strategy is learned to mitigate attacks and recover the quadrotor's tracking performance. We base our work on Agilicious, a state-of-the-art quadrotor recently deployed for autonomous settings. This paper is the first in the United Kingdom to deploy this quadrotor and implement reinforcement learning on its platform. Therefore, to promote easy reproducibility with minimal engineering overhead, we further provide (1) a comprehensive breakdown of this quadrotor, including software stacks and hardware alternatives; (2) a detailed reinforcement-learning framework to train autonomous controllers on Agilicious agents; and (3) a new open-source environment that builds upon PyFlyt for future reinforcement learning research on Agilicious platforms. Both simulated and real-world experiments are conducted to show the effectiveness of the proposed frameworks in section 5.2.
Recent Advances in OOD Detection: Problems and Approaches
Authors: Shuo Lu, YingSheng Wang, Lijun Sheng, Aihua Zheng, Lingxiao He, Jian Liang
Date: 2024-09-18 00:00:00
Tasks: Out-of-Distribution Detection, Out of Distribution (OOD) Detection, Survey, Test-time Adaptation

Out-of-distribution (OOD) detection aims to detect test samples outside the training category space, which is an essential component in building reliable machine learning systems. Existing reviews on OOD detection primarily focus on method taxonomy, surveying the field by categorizing various approaches. However, many recent works concentrate on non-traditional OOD detection scenarios, such as test-time adaptation, multi-modal data sources and other novel contexts. In this survey, we uniquely review recent advances in OOD detection from the problem scenario perspective for the first time. According to whether the training process is completely controlled, we divide OOD detection methods into training-driven and training-agnostic. Besides, considering the rapid development of pre-trained models, large pre-trained model-based OOD detection is also regarded as an important category and discussed separately. Furthermore, we provide a discussion of the evaluation scenarios, a variety of applications, and several future research directions. We believe this survey with new taxonomy will benefit the proposal of new methods and the expansion of more practical scenarios. A curated list of related papers is provided in the Github repository: https://github.com/shuolucs/Awesome-Out-Of-Distribution-Detection
Location based Probabilistic Load Forecasting of EV Charging Sites: Deep Transfer Learning with Multi-Quantile Temporal Convolutional Network
Authors: Mohammad Wazed Ali, Asif bin Mustafa, Md. Aukerul Moin Shuvo, Bernhard Sick
Date: 2024-09-18 00:00:00
Tasks: Load Forecasting, Transfer Learning

Electrification of vehicles is a potential way of reducing fossil fuel usage and thus lessening environmental pollution. Electric Vehicles (EVs) of various types for different transport modes (including air, water, and land) are evolving. Moreover, different EV user groups (commuters, commercial or domestic users, drivers) may use different charging infrastructures (public, private, home, and workplace) at various times. Therefore, usage patterns and energy demand are very stochastic. Characterizing and forecasting the charging demand of these diverse EV usage profiles is essential in preventing power outages. Previously developed data-driven load models are limited to specific use cases and locations. None of these models are simultaneously adaptive enough to transfer knowledge of day-ahead forecasting among EV charging sites of diverse locations, trained with limited data, and cost-effective. This article presents a location-based load forecasting of EV charging sites using a deep Multi-Quantile Temporal Convolutional Network (MQ-TCN) to overcome the limitations of earlier models. We conducted our experiments on data from four charging sites, namely Caltech, JPL, Office-1, and NREL, which have diverse EV user types like students, full-time and part-time employees, random visitors, etc. With a Prediction Interval Coverage Probability (PICP) score of 93.62\%, our proposed deep MQ-TCN model exhibited a remarkable 28.93\% improvement over the XGBoost model for a day-ahead load forecasting at the JPL charging site. By transferring knowledge with the inductive Transfer Learning (TL) approach, the MQ-TCN model achieved a 96.88\% PICP score for the load forecasting task at the NREL site using only two weeks of data.
Tight and Efficient Upper Bound on Spectral Norm of Convolutional Layers
Authors: Ekaterina Grishina, Mikhail Gorbunov, Maxim Rakhuba
Date: 2024-09-18 00:00:00

Controlling the spectral norm of the Jacobian matrix, which is related to the convolution operation, has been shown to improve generalization, training stability and robustness in CNNs. Existing methods for computing the norm either tend to overestimate it or their performance may deteriorate quickly with increasing the input and kernel sizes. In this paper, we demonstrate that the tensor version of the spectral norm of a four-dimensional convolution kernel, up to a constant factor, serves as an upper bound for the spectral norm of the Jacobian matrix associated with the convolution operation. This new upper bound is independent of the input image resolution, differentiable and can be efficiently calculated during training. Through experiments, we demonstrate how this new bound can be used to improve the performance of convolutional architectures.
Edge-Based Graph Component Pooling
Authors: T. Snelleman, B. M. Renting, H. H. Hoos, J. N. van Rijn
Date: 2024-09-18 00:00:00
Tasks: Sociology

Graph-structured data naturally occurs in many research fields, such as chemistry and sociology. The relational information contained therein can be leveraged to statistically model graph properties through geometrical deep learning. Graph neural networks employ techniques, such as message-passing layers, to propagate local features through a graph. However, message-passing layers can be computationally expensive when dealing with large and sparse graphs. Graph pooling operators offer the possibility of removing or merging nodes in such graphs, thus lowering computational costs. However, pooling operators that remove nodes cause data loss, and pooling operators that merge nodes are often computationally expensive. We propose a pooling operator that merges nodes so as not to cause data loss but is also conceptually simple and computationally inexpensive. We empirically demonstrate that the proposed pooling operator performs statistically significantly better than edge pool on four popular benchmark datasets while reducing time complexity and the number of trainable parameters by 70.6% on average. Compared to another maximally powerful method named Graph Isomporhic Network, we show that we outperform them on two popular benchmark datasets while reducing the number of learnable parameters on average by 60.9%.
An efficient wavelet-based physics-informed neural networks for singularly perturbed problems
Authors: Himanshu Pandey, Anshima Singh, Ratikanta Behera
Date: 2024-09-18 00:00:00

Physics-informed neural networks (PINNs) are a class of deep learning models that utilize physics as differential equations to address complex problems, including ones that may involve limited data availability. However, tackling solutions of differential equations with oscillations or singular perturbations and shock-like structures becomes challenging for PINNs. Considering these challenges, we designed an efficient wavelet-based PINNs (W-PINNs) model to solve singularly perturbed differential equations. Here, we represent the solution in wavelet space using a family of smooth-compactly supported wavelets. This framework represents the solution of a differential equation with significantly fewer degrees of freedom while still retaining in capturing, identifying, and analyzing the local structure of complex physical phenomena. The architecture allows the training process to search for a solution within wavelet space, making the process faster and more accurate. The proposed model does not rely on automatic differentiations for derivatives involved in differential equations and does not require any prior information regarding the behavior of the solution, such as the location of abrupt features. Thus, through a strategic fusion of wavelets with PINNs, W-PINNs excel at capturing localized nonlinear information, making them well-suited for problems showing abrupt behavior in certain regions, such as singularly perturbed problems. The efficiency and accuracy of the proposed neural network model are demonstrated in various test problems, i.e., highly singularly perturbed nonlinear differential equations, the FitzHugh-Nagumo (FHN), and Predator-prey interaction models. The proposed design model exhibits impressive comparisons with traditional PINNs and the recently developed wavelet-based PINNs, which use wavelets as an activation function for solving nonlinear differential equations.
Graph Neural Network-State Predictive Information Bottleneck (GNN-SPIB) approach for learning molecular thermodynamics and kinetics
Authors: Ziyue Zou, Dedi Wang, Pratyush Tiwary
Date: 2024-09-18 00:00:00
Tasks: Graph Neural Network

Molecular dynamics simulations offer detailed insights into atomic motions but face timescale limitations. Enhanced sampling methods have addressed these challenges but even with machine learning, they often rely on pre-selected expert-based features. In this work, we present the Graph Neural Network-State Predictive Information Bottleneck (GNN-SPIB) framework, which combines graph neural networks and the State Predictive Information Bottleneck to automatically learn low-dimensional representations directly from atomic coordinates. Tested on three benchmark systems, our approach predicts essential structural, thermodynamic and kinetic information for slow processes, demonstrating robustness across diverse systems. The method shows promise for complex systems, enabling effective enhanced sampling without requiring pre-defined reaction coordinates or input features.