pwc-archive/papers-with-abstracts huggingface dataset:
Context selectivity with dynamic availability enables lifelong continual learning
Authors: Martin Barry, Wulfram Gerstner, Guillaume Bellec
Date: 2023-06-02 00:00:00
Tasks: Continual Learning, Lifelong learning, Transfer Learning

"You never forget how to ride a bike", -- but how is that possible? The brain is able to learn complex skills, stop the practice for years, learn other skills in between, and still retrieve the original knowledge when necessary. The mechanisms of this capability, referred to as lifelong learning (or continual learning, CL), are unknown. We suggest a bio-plausible meta-plasticity rule building on classical work in CL which we summarize in two principles: (i) neurons are context selective, and (ii) a local availability variable partially freezes the plasticity if the neuron was relevant for previous tasks. In a new neuro-centric formalization of these principles, we suggest that neuron selectivity and neuron-wide consolidation is a simple and viable meta-plasticity hypothesis to enable CL in the brain. In simulation, this simple model balances forgetting and consolidation leading to better transfer learning than contemporary CL algorithms on image recognition and natural language processing CL benchmarks.
MKOR: Momentum-Enabled Kronecker-Factor-Based Optimizer Using Rank-1 Updates
Authors: Mohammad Mozaffari, Sikan Li, Zhao Zhang, Maryam Mehri Dehnavi
Date: 2023-06-02 00:00:00
Proceeding: NeurIPS 2023 11
Tasks: Second-order methods

This work proposes a Momentum-Enabled Kronecker-Factor-Based Optimizer Using Rank-1 updates, called MKOR, that improves the training time and convergence properties of deep neural networks (DNNs). Second-order techniques, while enjoying higher convergence rates vs first-order counterparts, have cubic complexity with respect to either the model size and/or the training batch size. Hence they exhibit poor scalability and performance in transformer models, e.g. large language models (LLMs), because the batch sizes in these models scale by the attention mechanism sequence length, leading to large model size and batch sizes. MKOR's complexity is quadratic with respect to the model size, alleviating the computation bottlenecks in second-order methods. Because of their high computation complexity, state-of-the-art implementations of second-order methods can only afford to update the second order information infrequently, and thus do not fully exploit the promise of better convergence from these updates. By reducing the communication complexity of the second-order updates as well as achieving a linear communication complexity, MKOR increases the frequency of second order updates. We also propose a hybrid version of MKOR (called MKOR-H) that mid-training falls backs to a first order optimizer if the second order updates no longer accelerate convergence. Our experiments show that MKOR outperforms state -of-the-art first order methods, e.g. the LAMB optimizer, and best implementations of second-order methods, i.e. KAISA/KFAC, up to 2.57x and 1.85x respectively on BERT-Large-Uncased on 64 GPUs.
Balancing Exploration and Exploitation: Disentangled $β$-CVAE in De Novo Drug Design
Authors: Guang Jun Nicholas Ang, De Tao Irwin Chin, Bingquan Shen
Date: 2023-06-02 00:00:00
Tasks: Disentanglement, Drug Design

Deep generative models have recently emerged as a promising de novo drug design method. In this respect, deep generative conditional variational autoencoder (CVAE) models are a powerful approach for generating novel molecules with desired drug-like properties. However, molecular graph-based models with disentanglement and multivariate explicit latent conditioning have not been fully elucidated. To address this, we proposed a molecular-graph $\beta$-CVAE model for de novo drug design. Here, we empirically tuned the value of disentanglement and assessed its ability to generate molecules with optimised univariate- or-multivariate properties. In particular, we optimised the octanol-water partition coefficient (ClogP), molar refractivity (CMR), quantitative estimate of drug-likeness (QED), and synthetic accessibility score (SAS). Results suggest that a lower $\beta$ value increases the uniqueness of generated molecules (exploration). Univariate optimisation results showed our model generated molecular property averages of ClogP = 41.07% $\pm$ 0.01% and CMR 66.76% $\pm$ 0.01% by the Ghose filter. Multivariate property optimisation results showed that our model generated an average of 30.07% $\pm$ 0.01% molecules for both desired properties. Furthermore, our model improved the QED and SAS (exploitation) of molecules generated. Together, these results suggest that the $\beta$-CVAE could balance exploration and exploitation through disentanglement and is a promising model for de novo drug design, thus providing a basis for future studies.
XAI Renaissance: Redefining Interpretability in Medical Diagnostic Models
Authors: Sujith K Mandala
Date: 2023-06-02 00:00:00
Tasks: Decision Making, Diagnostic, Explainable Artificial Intelligence (XAI)

As machine learning models become increasingly prevalent in medical diagnostics, the need for interpretability and transparency becomes paramount. The XAI Renaissance signifies a significant shift in the field, aiming to redefine the interpretability of medical diagnostic models. This paper explores the innovative approaches and methodologies within the realm of Explainable AI (XAI) that are revolutionizing the interpretability of medical diagnostic models. By shedding light on the underlying decision-making process, XAI techniques empower healthcare professionals to understand, trust, and effectively utilize these models for accurate and reliable medical diagnoses. This review highlights the key advancements in XAI for medical diagnostics and their potential to transform the healthcare landscape, ultimately improving patient outcomes and fostering trust in AI-driven diagnostic systems.
SourceP: Detecting Ponzi Schemes on Ethereum with Source Code
Authors: Pengcheng Lu, Liang Cai, Keting Yin
Date: 2023-06-02 00:00:00

As blockchain technology becomes more and more popular, a typical financial scam, the Ponzi scheme, has also emerged in the blockchain platform Ethereum. This Ponzi scheme deployed through smart contracts, also known as the smart Ponzi scheme, has caused a lot of economic losses and negative impacts. Existing methods for detecting smart Ponzi schemes on Ethereum mainly rely on bytecode features, opcode features, account features, and transaction behavior features of smart contracts, which are unable to truly characterize the behavioral features of Ponzi schemes, and thus generally perform poorly in terms of detection accuracy and false alarm rates. In this paper, we propose SourceP, a method to detect smart Ponzi schemes on the Ethereum platform using pre-trained models and data flow, which only requires using the source code of smart contracts as features. SourceP reduces the difficulty of data acquisition and feature extraction of existing detection methods. Specifically, we first convert the source code of a smart contract into a data flow graph and then introduce a pre-trained model based on learning code representations to build a classification model to identify Ponzi schemes in smart contracts. The experimental results show that SourceP achieves 87.2% recall and 90.7% F-score for detecting smart Ponzi schemes within Ethereum's smart contract dataset, outperforming state-of-the-art methods in terms of performance and sustainability. We also demonstrate through additional experiments that pre-trained models and data flow play an important contribution to SourceP, as well as proving that SourceP has a good generalization ability.
DiffusEmp: A Diffusion Model-Based Framework with Multi-Grained Control for Empathetic Response Generation
Authors: Guanqun Bi, Lei Shen, Yanan Cao, Meng Chen, Yuqiang Xie, Zheng Lin, Xiaodong He
Date: 2023-06-02 00:00:00
Tasks: Attribute, Diversity, Empathetic Response Generation, Informativeness, Language Modeling, Language Modelling, Response Generation

Empathy is a crucial factor in open-domain conversations, which naturally shows one's caring and understanding to others. Though several methods have been proposed to generate empathetic responses, existing works often lead to monotonous empathy that refers to generic and safe expressions. In this paper, we propose to use explicit control to guide the empathy expression and design a framework DiffusEmp based on conditional diffusion language model to unify the utilization of dialogue context and attribute-oriented control signals. Specifically, communication mechanism, intent, and semantic frame are imported as multi-grained signals that control the empathy realization from coarse to fine levels. We then design a specific masking strategy to reflect the relationship between multi-grained signals and response tokens, and integrate it into the diffusion model to influence the generative process. Experimental results on a benchmark dataset EmpatheticDialogue show that our framework outperforms competitive baselines in terms of controllability, informativeness, and diversity without the loss of context-relatedness.
Bi-level Contrastive Learning for Knowledge-Enhanced Molecule Representations
Authors: Pengcheng Jiang, Cao Xiao, Tianfan Fu, Parminder Bhatia, Taha Kass-Hout, Jimeng Sun, Jiawei Han
Date: 2023-06-02 00:00:00
Tasks: Contrastive Learning, Knowledge Graphs, Molecular Property Prediction, molecular representation, Property Prediction, regression, Representation Learning

Molecular representation learning is vital for various downstream applications, including the analysis and prediction of molecular properties and side effects. While Graph Neural Networks (GNNs) have been a popular framework for modeling molecular data, they often struggle to capture the full complexity of molecular representations. In this paper, we introduce a novel method called GODE, which accounts for the dual-level structure inherent in molecules. Molecules possess an intrinsic graph structure and simultaneously function as nodes within a broader molecular knowledge graph. GODE integrates individual molecular graph representations with multi-domain biochemical data from knowledge graphs. By pre-training two GNNs on different graph structures and employing contrastive learning, GODE effectively fuses molecular structures with their corresponding knowledge graph substructures. This fusion yields a more robust and informative representation, enhancing molecular property predictions by leveraging both chemical and biological information. When fine-tuned across 11 chemical property tasks, our model significantly outperforms existing benchmarks, achieving an average ROC-AUC improvement of 12.7% for classification tasks and an average RMSE/MAE improvement of 34.4% for regression tasks. Notably, GODE surpasses the current leading model in property prediction, with advancements of 2.2% in classification and 7.2% in regression tasks.
HomE: Homography-Equivariant Video Representation Learning
Authors: Anirudh Sriram, Adrien Gaidon, Jiajun Wu, Juan Carlos Niebles, Li Fei-Fei, Ehsan Adeli
Date: 2023-06-02 00:00:00
Tasks: Action Classification, Action Recognition, Representation Learning, Self-Supervised Learning

Recent advances in self-supervised representation learning have enabled more efficient and robust model performance without relying on extensive labeled data. However, most works are still focused on images, with few working on videos and even fewer on multi-view videos, where more powerful inductive biases can be leveraged for self-supervision. In this work, we propose a novel method for representation learning of multi-view videos, where we explicitly model the representation space to maintain Homography Equivariance (HomE). Our method learns an implicit mapping between different views, culminating in a representation space that maintains the homography relationship between neighboring views. We evaluate our HomE representation via action recognition and pedestrian intent prediction as downstream tasks. On action classification, our method obtains 96.4% 3-fold accuracy on the UCF101 dataset, better than most state-of-the-art self-supervised learning methods. Similarly, on the STIP dataset, we outperform the state-of-the-art by 6% for pedestrian intent prediction one second into the future while also obtaining an accuracy of 91.2% for pedestrian action (cross vs. not-cross) classification. Code is available at https://github.com/anirudhs123/HomE.
Log Parsing: How Far Can ChatGPT Go?
Authors: Van-Hoang Le, Hongyu Zhang
Date: 2023-06-02 00:00:00
Tasks: Language Modeling, Language Modelling, Large Language Model, Log Parsing

Software logs play an essential role in ensuring the reliability and maintainability of large-scale software systems, as they are often the sole source of runtime information. Log parsing, which converts raw log messages into structured data, is an important initial step towards downstream log analytics. In recent studies, ChatGPT, the current cutting-edge large language model (LLM), has been widely applied to a wide range of software engineering tasks. However, its performance in automated log parsing remains unclear. In this paper, we evaluate ChatGPT's ability to undertake log parsing by addressing two research questions. (1) Can ChatGPT effectively parse logs? (2) How does ChatGPT perform with different prompting methods? Our results show that ChatGPT can achieve promising results for log parsing with appropriate prompts, especially with few-shot prompting. Based on our findings, we outline several challenges and opportunities for ChatGPT-based log parsing.
Probabilistic Concept Bottleneck Models
Authors: Eunji Kim, Dahuin Jung, Sangha Park, Siwon Kim, Sungroh Yoon
Date: 2023-06-02 00:00:00
Tasks: Prediction

Interpretable models are designed to make decisions in a human-interpretable manner. Representatively, Concept Bottleneck Models (CBM) follow a two-step process of concept prediction and class prediction based on the predicted concepts. CBM provides explanations with high-level concepts derived from concept predictions; thus, reliable concept predictions are important for trustworthiness. In this study, we address the ambiguity issue that can harm reliability. While the existence of a concept can often be ambiguous in the data, CBM predicts concepts deterministically without considering this ambiguity. To provide a reliable interpretation against this ambiguity, we propose Probabilistic Concept Bottleneck Models (ProbCBM). By leveraging probabilistic concept embeddings, ProbCBM models uncertainty in concept prediction and provides explanations based on the concept and its corresponding uncertainty. This uncertainty enhances the reliability of the explanations. Furthermore, as class uncertainty is derived from concept uncertainty in ProbCBM, we can explain class uncertainty by means of concept uncertainty. Code is publicly available at https://github.com/ejkim47/prob-cbm.
PassGPT: Password Modeling and (Guided) Generation with Large Language Models
Authors: Javier Rando, Fernando Perez-Cruz, Briland Hitaj
Date: 2023-06-02 00:00:00

Large language models (LLMs) successfully model natural language from vast amounts of text without the need for explicit supervision. In this paper, we investigate the efficacy of LLMs in modeling passwords. We present PassGPT, a LLM trained on password leaks for password generation. PassGPT outperforms existing methods based on generative adversarial networks (GAN) by guessing twice as many previously unseen passwords. Furthermore, we introduce the concept of guided password generation, where we leverage PassGPT sampling procedure to generate passwords matching arbitrary constraints, a feat lacking in current GAN-based strategies. Lastly, we conduct an in-depth analysis of the entropy and probability distribution that PassGPT defines over passwords and discuss their use in enhancing existing password strength estimators.
One for All: Unified Workload Prediction for Dynamic Multi-tenant Edge Cloud Platforms
Authors: Shaoyuan Huang, Zheng Wang, Heng Zhang, Xiaofei Wang, Cheng Zhang, Wenyu Wang
Date: 2023-06-02 00:00:00
Tasks: All, Prediction, Time Series, Time Series Prediction

Workload prediction in multi-tenant edge cloud platforms (MT-ECP) is vital for efficient application deployment and resource provisioning. However, the heterogeneous application patterns, variable infrastructure performance, and frequent deployments in MT-ECP pose significant challenges for accurate and efficient workload prediction. Clustering-based methods for dynamic MT-ECP modeling often incur excessive costs due to the need to maintain numerous data clusters and models, which leads to excessive costs. Existing end-to-end time series prediction methods are challenging to provide consistent prediction performance in dynamic MT-ECP. In this paper, we propose an end-to-end framework with global pooling and static content awareness, DynEformer, to provide a unified workload prediction scheme for dynamic MT-ECP. Meticulously designed global pooling and information merging mechanisms can effectively identify and utilize global application patterns to drive local workload predictions. The integration of static content-aware mechanisms enhances model robustness in real-world scenarios. Through experiments on five real-world datasets, DynEformer achieved state-of-the-art in the dynamic scene of MT-ECP and provided a unified end-to-end prediction scheme for MT-ECP.
Supervised Adversarial Contrastive Learning for Emotion Recognition in Conversations
Authors: Dou Hu, Yinan Bao, Lingwei Wei, Wei Zhou, Songlin Hu
Date: 2023-06-02 00:00:00
Tasks: Contrastive Learning, Emotion Recognition, Emotion Recognition in Conversation

Extracting generalized and robust representations is a major challenge in emotion recognition in conversations (ERC). To address this, we propose a supervised adversarial contrastive learning (SACL) framework for learning class-spread structured representations in a supervised manner. SACL applies contrast-aware adversarial training to generate worst-case samples and uses joint class-spread contrastive learning to extract structured representations. It can effectively utilize label-level feature consistency and retain fine-grained intra-class features. To avoid the negative impact of adversarial perturbations on context-dependent data, we design a contextual adversarial training (CAT) strategy to learn more diverse features from context and enhance the model's context robustness. Under the framework with CAT, we develop a sequence-based SACL-LSTM to learn label-consistent and context-robust features for ERC. Experiments on three datasets show that SACL-LSTM achieves state-of-the-art performance on ERC. Extended experiments prove the effectiveness of SACL and CAT.
Accelerating science with human-aware artificial intelligence
Authors: Jamshid Sourati, James Evans
Date: 2023-06-02 00:00:00

Artificial intelligence (AI) models trained on published scientific findings have been used to invent valuable materials and targeted therapies, but they typically ignore the human scientists who continually alter the landscape of discovery. Here we show that incorporating the distribution of human expertise by training unsupervised models on simulated inferences cognitively accessible to experts dramatically improves (up to 400%) AI prediction of future discoveries beyond those focused on research content alone, especially when relevant literature is sparse. These models succeed by predicting human predictions and the scientists who will make them. By tuning human-aware AI to avoid the crowd, we can generate scientifically promising "alien" hypotheses unlikely to be imagined or pursued without intervention until the distant future, which hold promise to punctuate scientific advance beyond questions currently pursued. Accelerating human discovery or probing its blind spots, human-aware AI enables us to move toward and beyond the contemporary scientific frontier.
Robust low-rank training via approximate orthonormal constraints
Date: 2023-06-02 00:00:00
Proceeding: NeurIPS 2023 11
Tasks: Adversarial Robustness

With the growth of model and data sizes, a broad effort has been made to design pruning techniques that reduce the resource demand of deep learning pipelines, while retaining model performance. In order to reduce both inference and training costs, a prominent line of work uses low-rank matrix factorizations to represent the network weights. Although able to retain accuracy, we observe that low-rank methods tend to compromise model robustness against adversarial perturbations. By modeling robustness in terms of the condition number of the neural network, we argue that this loss of robustness is due to the exploding singular values of the low-rank weight matrices. Thus, we introduce a robust low-rank training algorithm that maintains the network's weights on the low-rank matrix manifold while simultaneously enforcing approximate orthonormal constraints. The resulting model reduces both training and inference costs while ensuring well-conditioning and thus better adversarial robustness, without compromising model accuracy. This is shown by extensive numerical evidence and by our main approximation theorem that shows the computed robust low-rank network well-approximates the ideal full model, provided a highly performing low-rank sub-network exists.
Theoretical Behavior of XAI Methods in the Presence of Suppressor Variables
Authors: Rick Wilming, Leo Kieslich, Benedict Clark, Stefan Haufe
Date: 2023-06-02 00:00:00
Tasks: Attribute, Binary Classification, Explainable artificial intelligence, Explainable Artificial Intelligence (XAI)

In recent years, the community of 'explainable artificial intelligence' (XAI) has created a vast body of methods to bridge a perceived gap between model 'complexity' and 'interpretability'. However, a concrete problem to be solved by XAI methods has not yet been formally stated. As a result, XAI methods are lacking theoretical and empirical evidence for the 'correctness' of their explanations, limiting their potential use for quality-control and transparency purposes. At the same time, Haufe et al. (2014) showed, using simple toy examples, that even standard interpretations of linear models can be highly misleading. Specifically, high importance may be attributed to so-called suppressor variables lacking any statistical relation to the prediction target. This behavior has been confirmed empirically for a large array of XAI methods in Wilming et al. (2022). Here, we go one step further by deriving analytical expressions for the behavior of a variety of popular XAI methods on a simple two-dimensional binary classification problem involving Gaussian class-conditional distributions. We show that the majority of the studied approaches will attribute non-zero importance to a non-class-related suppressor feature in the presence of correlated noise. This poses important limitations on the interpretations and conclusions that the outputs of these XAI methods can afford.