pwc-archive/papers-with-abstracts huggingface dataset:
On Optimal Sampling for Learning SDF Using MLPs Equipped with Positional Encoding
Authors: Guying Lin, Lei Yang, YuAn Liu, Congyi Zhang, Junhui Hou, Xiaogang Jin, Taku Komura, John Keyser, Wenping Wang
Date: 2024-01-02 00:00:00

Neural implicit fields, such as the neural signed distance field (SDF) of a shape, have emerged as a powerful representation for many applications, e.g., encoding a 3D shape and performing collision detection. Typically, implicit fields are encoded by Multi-layer Perceptrons (MLP) with positional encoding (PE) to capture high-frequency geometric details. However, a notable side effect of such PE-equipped MLPs is the noisy artifacts present in the learned implicit fields. While increasing the sampling rate could in general mitigate these artifacts, in this paper we aim to explain this adverse phenomenon through the lens of Fourier analysis. We devise a tool to determine the appropriate sampling rate for learning an accurate neural implicit field without undesirable side effects. Specifically, we propose a simple yet effective method to estimate the intrinsic frequency of a given network with randomized weights based on the Fourier analysis of the network's responses. It is observed that a PE-equipped MLP has an intrinsic frequency much higher than the highest frequency component in the PE layer. Sampling against this intrinsic frequency following the Nyquist-Sannon sampling theorem allows us to determine an appropriate training sampling rate. We empirically show in the setting of SDF fitting that this recommended sampling rate is sufficient to secure accurate fitting results, while further increasing the sampling rate would not further noticeably reduce the fitting error. Training PE-equipped MLPs simply with our sampling strategy leads to performances superior to the existing methods.
DiffAugment: Diffusion based Long-Tailed Visual Relationship Recognition
Authors: Parul Gupta, Tuan Nguyen, Abhinav Dhall, Munawar Hayat, Trung Le, Thanh-Toan Do
Date: 2024-01-01 00:00:00
Tasks: Object, Relation, Triplet

The task of Visual Relationship Recognition (VRR) aims to identify relationships between two interacting objects in an image and is particularly challenging due to the widely-spread and highly imbalanced distribution of <subject, relation, object> triplets. To overcome the resultant performance bias in existing VRR approaches, we introduce DiffAugment -- a method which first augments the tail classes in the linguistic space by making use of WordNet and then utilizes the generative prowess of Diffusion Models to expand the visual space for minority classes. We propose a novel hardness-aware component in diffusion which is based upon the hardness of each <S,R,O> triplet and demonstrate the effectiveness of hardness-aware diffusion in generating visual embeddings for the tail classes. We also propose a novel subject and object based seeding strategy for diffusion sampling which improves the discriminative capability of the generated visual embeddings. Extensive experimentation on the GQA-LT dataset shows favorable gains in the subject/object and relation average per-class accuracy using Diffusion augmented samples.
Tissue Artifact Segmentation and Severity Analysis for Automated Diagnosis Using Whole Slide Images
Authors: Galib Muhammad Shahriar Himel
Date: 2024-01-01 00:00:00
Tasks: Artifact Detection, whole slide images

Traditionally, pathological analysis and diagnosis are performed by manually eyeballing glass slide specimens under a microscope by an expert. The whole slide image is the digital specimen produced from the glass slide. Whole slide image enabled specimens to be observed on a computer screen and led to computational pathology where computer vision and artificial intelligence are utilized for automated analysis and diagnosis. With the current computational advancement, the entire whole slide image can be analyzed autonomously without human supervision. However, the analysis could fail or lead to wrong diagnosis if the whole slide image is affected by tissue artifacts such as tissue fold or air bubbles depending on the severity. Existing artifact detection methods rely on experts for severity assessment to eliminate artifact affected regions from the analysis. This process is time consuming, exhausting and undermines the goal of automated analysis or removal of artifacts without evaluating their severity, which could result in the loss of diagnostically important data. Therefore, it is necessary to detect artifacts and then assess their severity automatically. In this paper, we propose a system that incorporates severity evaluation with artifact detection utilizing convolutional neural networks. The proposed system uses DoubleUNet to segment artifacts and an ensemble network of six fine tuned convolutional neural network models to determine severity. This method outperformed current state of the art in accuracy by 9 percent for artifact segmentation and achieved a strong correlation of 97 percent with the evaluation of pathologists for severity assessment. The robustness of the system was demonstrated using our proposed heterogeneous dataset and practical usability was ensured by integrating it with an automated analysis system.
Exploring Multi-Modal Control in Music-Driven Dance Generation
Authors: Ronghui Li, Yuqin Dai, Yachao Zhang, Jun Li, Jian Yang, Jie Guo, Xiu Li
Date: 2024-01-01 00:00:00

Existing music-driven 3D dance generation methods mainly concentrate on high-quality dance generation, but lack sufficient control during the generation process. To address these issues, we propose a unified framework capable of generating high-quality dance movements and supporting multi-modal control, including genre control, semantic control, and spatial control. First, we decouple the dance generation network from the dance control network, thereby avoiding the degradation in dance quality when adding additional control information. Second, we design specific control strategies for different control information and integrate them into a unified framework. Experimental results show that the proposed dance generation framework outperforms state-of-the-art methods in terms of motion quality and controllability.
Mapping Walnut Water Stress with High Resolution Multispectral UAV Imagery and Machine Learning
Authors: Kaitlyn Wang, Yufang Jin
Date: 2023-12-30 00:00:00
Tasks: Management

Effective monitoring of walnut water status and stress level across the whole orchard is an essential step towards precision irrigation management of walnuts, a significant crop in California. This study presents a machine learning approach using Random Forest (RF) models to map stem water potential (SWP) by integrating high-resolution multispectral remote sensing imagery from Unmanned Aerial Vehicle (UAV) flights with weather data. From 2017 to 2018, five flights of an UAV equipped with a seven-band multispectral camera were conducted over a commercial walnut orchard, paired with concurrent ground measurements of sampled walnut plants. The RF regression model, utilizing vegetation indices derived from orthomosaiced UAV imagery and weather data, effectively estimated ground-measured SWPs, achieving an $R^2$ of 0.63 and a mean absolute error (MAE) of 0.80 bars. The integration of weather data was particularly crucial for consolidating data across various flight dates. Significant variables for SWP estimation included wind speed and vegetation indices such as NDVI, NDRE, and PSRI.A reduced RF model excluding red-edge indices of NDRE and PSRI, demonstrated slightly reduced accuracy ($R^2$ = 0.54). Additionally, the RF classification model predicted water stress levels in walnut trees with 85% accuracy, surpassing the 80% accuracy of the reduced classification model. The results affirm the efficacy of UAV-based multispectral imaging combined with machine learning, incorporating thermal data, NDVI, red-edge indices, and weather data, in walnut water stress estimation and assessment. This methodology offers a scalable, cost-effective tool for data-driven precision irrigation management at an individual plant level in walnut orchards.
Mining Temporal Attack Patterns from Cyberthreat Intelligence Reports
Authors: Md Rayhanur Rahman, Brandon Wroblewski, Quinn Matthews, Brantley Morgan, Tim Menzies, Laurie Williams
Date: 2024-01-03 00:00:00

Defending from cyberattacks requires practitioners to operate on high-level adversary behavior. Cyberthreat intelligence (CTI) reports on past cyberattack incidents describe the chain of malicious actions with respect to time. To avoid repeating cyberattack incidents, practitioners must proactively identify and defend against recurring chain of actions - which we refer to as temporal attack patterns. Automatically mining the patterns among actions provides structured and actionable information on the adversary behavior of past cyberattacks. The goal of this paper is to aid security practitioners in prioritizing and proactive defense against cyberattacks by mining temporal attack patterns from cyberthreat intelligence reports. To this end, we propose ChronoCTI, an automated pipeline for mining temporal attack patterns from cyberthreat intelligence (CTI) reports of past cyberattacks. To construct ChronoCTI, we build the ground truth dataset of temporal attack patterns and apply state-of-the-art large language models, natural language processing, and machine learning techniques. We apply ChronoCTI on a set of 713 CTI reports, where we identify 124 temporal attack patterns - which we categorize into nine pattern categories. We identify that the most prevalent pattern category is to trick victim users into executing malicious code to initiate the attack, followed by bypassing the anti-malware system in the victim network. Based on the observed patterns, we advocate organizations to train users about cybersecurity best practices, introduce immutable operating systems with limited functionalities, and enforce multi-user authentications. Moreover, we advocate practitioners to leverage the automated mining capability of ChronoCTI and design countermeasures against the recurring attack patterns.
Theoretical guarantees on the best-of-n alignment policy
Authors: Ahmad Beirami, Alekh Agarwal, Jonathan Berant, Alexander D'Amour, Jacob Eisenstein, Chirag Nagpal, Ananda Theertha Suresh
Date: 2024-01-03 00:00:00

A simple and effective method for the inference-time alignment and scaling test-time compute of generative models is best-of-$n$ sampling, where $n$ samples are drawn from a reference policy, ranked based on a reward function, and the highest ranking one is selected. A commonly used analytical expression in the literature claims that the KL divergence between the best-of-$n$ policy and the reference policy is equal to $\log (n) - (n-1)/n.$ We disprove the validity of this claim, and show that it is an upper bound on the actual KL divergence. We also explore the tightness of this upper bound in different regimes, and propose a new estimator for the KL divergence and empirically show that it provides a tight approximation. We also show that the win rate of the best-of-$n$ policy against the reference policy is upper bounded by $n/(n+1)$ and derive bounds on the tightness of this characterization. We conclude with analyzing the tradeoffs between win rate and KL divergence of the best-of-$n$ alignment policy, which demonstrate that very good tradeoffs are achievable with $n < 1000$.
Graph Neural Networks for Surfactant Multi-Property Prediction
Authors: Christoforos Brozos, Jan G. Rittig, Sandip Bhattacharya, Elie Akanny, Christina Kohlmann, Alexander Mitsos
Date: 2024-01-03 00:00:00
Tasks: Ensemble Learning, Multi-Task Learning, Prediction, Property Prediction, Transfer Learning

Surfactants are of high importance in different industrial sectors such as cosmetics, detergents, oil recovery and drug delivery systems. Therefore, many quantitative structure-property relationship (QSPR) models have been developed for surfactants. Each predictive model typically focuses on one surfactant class, mostly nonionics. Graph Neural Networks (GNNs) have exhibited a great predictive performance for property prediction of ionic liquids, polymers and drugs in general. Specifically for surfactants, GNNs can successfully predict critical micelle concentration (CMC), a key surfactant property associated with micellization. A key factor in the predictive ability of QSPR and GNN models is the data available for training. Based on extensive literature search, we create the largest available CMC database with 429 molecules and the first large data collection for surface excess concentration ($\Gamma$$_{m}$), another surfactant property associated with foaming, with 164 molecules. Then, we develop GNN models to predict the CMC and $\Gamma$$_{m}$ and we explore different learning approaches, i.e., single- and multi-task learning, as well as different training strategies, namely ensemble and transfer learning. We find that a multi-task GNN with ensemble learning trained on all $\Gamma$$_{m}$ and CMC data performs best. Finally, we test the ability of our CMC model to generalize on industrial grade pure component surfactants. The GNN yields highly accurate predictions for CMC, showing great potential for future industrial applications.
On the hardness of learning under symmetries
Authors: Bobak T. Kiani, Thien Le, Hannah Lawrence, Stefanie Jegelka, Melanie Weber
Date: 2024-01-03 00:00:00
Tasks: Inductive Bias

We study the problem of learning equivariant neural networks via gradient descent. The incorporation of known symmetries ("equivariance") into neural nets has empirically improved the performance of learning pipelines, in domains ranging from biology to computer vision. However, a rich yet separate line of learning theoretic research has demonstrated that actually learning shallow, fully-connected (i.e. non-symmetric) networks has exponential complexity in the correlational statistical query (CSQ) model, a framework encompassing gradient descent. In this work, we ask: are known problem symmetries sufficient to alleviate the fundamental hardness of learning neural nets with gradient descent? We answer this question in the negative. In particular, we give lower bounds for shallow graph neural networks, convolutional networks, invariant polynomials, and frame-averaged networks for permutation subgroups, which all scale either superpolynomially or exponentially in the relevant input dimension. Therefore, in spite of the significant inductive bias imparted via symmetry, actually learning the complete classes of functions represented by equivariant neural networks via gradient descent remains hard.
Dataset Difficulty and the Role of Inductive Bias
Authors: Devin Kwok, Nikhil Anand, Jonathan Frankle, Gintare Karolina Dziugaite, David Rolnick
Date: 2024-01-03 00:00:00
Tasks: Inductive Bias

Motivated by the goals of dataset pruning and defect identification, a growing body of methods have been developed to score individual examples within a dataset. These methods, which we call "example difficulty scores", are typically used to rank or categorize examples, but the consistency of rankings between different training runs, scoring methods, and model architectures is generally unknown. To determine how example rankings vary due to these random and controlled effects, we systematically compare different formulations of scores over a range of runs and model architectures. We find that scores largely share the following traits: they are noisy over individual runs of a model, strongly correlated with a single notion of difficulty, and reveal examples that range from being highly sensitive to insensitive to the inductive biases of certain model architectures. Drawing from statistical genetics, we develop a simple method for fingerprinting model architectures using a few sensitive examples. These findings guide practitioners in maximizing the consistency of their scores (e.g. by choosing appropriate scoring methods, number of runs, and subsets of examples), and establishes comprehensive baselines for evaluating scores in the future.
Optimal cross-learning for contextual bandits with unknown context distributions
Authors: Jon Schneider, Julian Zimmert
Date: 2024-01-03 00:00:00
Proceeding: NeurIPS 2023 11
Tasks: Multi-Armed Bandits

We consider the problem of designing contextual bandit algorithms in the ``cross-learning'' setting of Balseiro et al., where the learner observes the loss for the action they play in all possible contexts, not just the context of the current round. We specifically consider the setting where losses are chosen adversarially and contexts are sampled i.i.d. from an unknown distribution. In this setting, we resolve an open problem of Balseiro et al. by providing an efficient algorithm with a nearly tight (up to logarithmic factors) regret bound of $\widetilde{O}(\sqrt{TK})$, independent of the number of contexts. As a consequence, we obtain the first nearly tight regret bounds for the problems of learning to bid in first-price auctions (under unknown value distributions) and sleeping bandits with a stochastic action set. At the core of our algorithm is a novel technique for coordinating the execution of a learning algorithm over multiple epochs in such a way to remove correlations between estimation of the unknown distribution and the actions played by the algorithm. This technique may be of independent interest for other learning problems involving estimation of an unknown context distribution.
Transformer Neural Autoregressive Flows
Authors: Massimiliano Patacchiola, Aliaksandra Shysheya, Katja Hofmann, Richard E. Turner
Date: 2024-01-03 00:00:00
Tasks: Density Estimation

Density estimation, a central problem in machine learning, can be performed using Normalizing Flows (NFs). NFs comprise a sequence of invertible transformations, that turn a complex target distribution into a simple one, by exploiting the change of variables theorem. Neural Autoregressive Flows (NAFs) and Block Neural Autoregressive Flows (B-NAFs) are arguably the most perfomant members of the NF family. However, they suffer scalability issues and training instability due to the constraints imposed on the network structure. In this paper, we propose a novel solution to these challenges by exploiting transformers to define a new class of neural flows called Transformer Neural Autoregressive Flows (T-NAFs). T-NAFs treat each dimension of a random variable as a separate input token, using attention masking to enforce an autoregressive constraint. We take an amortization-inspired approach where the transformer outputs the parameters of an invertible transformation. The experimental results demonstrate that T-NAFs consistently match or outperform NAFs and B-NAFs across multiple datasets from the UCI benchmark. Remarkably, T-NAFs achieve these results using an order of magnitude fewer parameters than previous approaches, without composing multiple flows.
DGDNN: Decoupled Graph Diffusion Neural Network for Stock Movement Prediction
Authors: Zinuo You, Zijian Shi, Hongbo Bo, John Cartlidge, Li Zhang, Yan Ge
Date: 2024-01-03 00:00:00
Tasks: Graph Learning, Representation Learning

Forecasting future stock trends remains challenging for academia and industry due to stochastic inter-stock dynamics and hierarchical intra-stock dynamics influencing stock prices. In recent years, graph neural networks have achieved remarkable performance in this problem by formulating multiple stocks as graph-structured data. However, most of these approaches rely on artificially defined factors to construct static stock graphs, which fail to capture the intrinsic interdependencies between stocks that rapidly evolve. In addition, these methods often ignore the hierarchical features of the stocks and lose distinctive information within. In this work, we propose a novel graph learning approach implemented without expert knowledge to address these issues. First, our approach automatically constructs dynamic stock graphs by entropy-driven edge generation from a signal processing perspective. Then, we further learn task-optimal dependencies between stocks via a generalized graph diffusion process on constructed stock graphs. Last, a decoupled representation learning scheme is adopted to capture distinctive hierarchical intra-stock features. Experimental results demonstrate substantial improvements over state-of-the-art baselines on real-world datasets. Moreover, the ablation study and sensitivity study further illustrate the effectiveness of the proposed method in modeling the time-evolving inter-stock and intra-stock dynamics.
Wasserstein Nonnegative Tensor Factorization with Manifold Regularization
Authors: Jianyu Wang, Linruize Tang
Date: 2024-01-03 00:00:00

Nonnegative tensor factorization (NTF) has become an important tool for feature extraction and part-based representation with preserved intrinsic structure information from nonnegative high-order data. However, the original NTF methods utilize Euclidean or Kullback-Leibler divergence as the loss function which treats each feature equally leading to the neglect of the side-information of features. To utilize correlation information of features and manifold information of samples, we introduce Wasserstein manifold nonnegative tensor factorization (WMNTF), which minimizes the Wasserstein distance between the distribution of input tensorial data and the distribution of reconstruction. Although some researches about Wasserstein distance have been proposed in nonnegative matrix factorization (NMF), they ignore the spatial structure information of higher-order data. We use Wasserstein distance (a.k.a Earth Mover's distance or Optimal Transport distance) as a metric and add a graph regularizer to a latent factor. Experimental results demonstrate the effectiveness of the proposed method compared with other NMF and NTF methods.
Signal Processing in the Retina: Interpretable Graph Classifier to Predict Ganglion Cell Responses
Authors: Yasaman Parhizkar, Gene Cheung, Andrew W. Eckford
Date: 2024-01-03 00:00:00
Tasks: Binary Classification, Metric Learning

It is a popular hypothesis in neuroscience that ganglion cells in the retina are activated by selectively detecting visual features in an observed scene. While ganglion cell firings can be predicted via data-trained deep neural nets, the networks remain indecipherable, thus providing little understanding of the cells' underlying operations. To extract knowledge from the cell firings, in this paper we learn an interpretable graph-based classifier from data to predict the firings of ganglion cells in response to visual stimuli. Specifically, we learn a positive semi-definite (PSD) metric matrix $\mathbf{M} \succeq 0$ that defines Mahalanobis distances between graph nodes (visual events) endowed with pre-computed feature vectors; the computed inter-node distances lead to edge weights and a combinatorial graph that is amenable to binary classification. Mathematically, we define the objective of metric matrix $\mathbf{M}$ optimization using a graph adaptation of large margin nearest neighbor (LMNN), which is rewritten as a semi-definite programming (SDP) problem. We solve it efficiently via a fast approximation called Gershgorin disc perfect alignment (GDPA) linearization. The learned metric matrix $\mathbf{M}$ provides interpretability: important features are identified along $\mathbf{M}$'s diagonal, and their mutual relationships are inferred from off-diagonal terms. Our fast metric learning framework can be applied to other biological systems with pre-chosen features that require interpretation.