pwc-archive/papers-with-abstracts huggingface dataset:
Tab2KG: Semantic Table Interpretation with Lightweight Semantic Profiles
Authors: Simon Gottschalk, Elena Demidova
Date: 2023-02-02 00:00:00
Tasks: One-Shot Learning

Tabular data plays an essential role in many data analytics and machine learning tasks. Typically, tabular data does not possess any machine-readable semantics. In this context, semantic table interpretation is crucial for making data analytics workflows more robust and explainable. This article proposes Tab2KG - a novel method that targets at the interpretation of tables with previously unseen data and automatically infers their semantics to transform them into semantic data graphs. We introduce original lightweight semantic profiles that enrich a domain ontology's concepts and relations and represent domain and table characteristics. We propose a one-shot learning approach that relies on these profiles to map a tabular dataset containing previously unseen instances to a domain ontology. In contrast to the existing semantic table interpretation approaches, Tab2KG relies on the semantic profiles only and does not require any instance lookup. This property makes Tab2KG particularly suitable in the data analytics context, in which data tables typically contain new instances. Our experimental evaluation on several real-world datasets from different application domains demonstrates that Tab2KG outperforms state-of-the-art semantic table interpretation baselines.
De Novo Molecular Generation via Connection-aware Motif Mining
Authors: Zijie Geng, Shufang Xie, Yingce Xia, Lijun Wu, Tao Qin, Jie Wang, Yongdong Zhang, Feng Wu, Tie-Yan Liu
Date: 2023-02-02 00:00:00

De novo molecular generation is an essential task for science discovery. Recently, fragment-based deep generative models have attracted much research attention due to their flexibility in generating novel molecules based on existing molecule fragments. However, the motif vocabulary, i.e., the collection of frequent fragments, is usually built upon heuristic rules, which brings difficulties to capturing common substructures from large amounts of molecules. In this work, we propose a new method, MiCaM, to generate molecules based on mined connection-aware motifs. Specifically, it leverages a data-driven algorithm to automatically discover motifs from a molecule library by iteratively merging subgraphs based on their frequency. The obtained motif vocabulary consists of not only molecular motifs (i.e., the frequent fragments), but also their connection information, indicating how the motifs are connected with each other. Based on the mined connection-aware motifs, MiCaM builds a connection-aware generator, which simultaneously picks up motifs and determines how they are connected. We test our method on distribution-learning benchmarks (i.e., generating novel molecules to resemble the distribution of a given training set) and goal-directed benchmarks (i.e., generating molecules with target properties), and achieve significant improvements over previous fragment-based baselines. Furthermore, we demonstrate that our method can effectively mine domain-specific motifs for different tasks.
Mnemosyne: Learning to Train Transformers with Transformers
Date: 2023-02-02 00:00:00
Proceeding: NeurIPS 2023 11
Tasks: Feature Engineering

In this work, we propose a new class of learnable optimizers, called \textit{Mnemosyne}. It is based on the novel spatio-temporal low-rank implicit attention Transformers that can learn to train entire neural network architectures, including other Transformers, without any task-specific optimizer tuning. We show that Mnemosyne: (a) outperforms popular LSTM optimizers (also with new feature engineering to mitigate catastrophic forgetting of LSTMs), (b) can successfully train Transformers while using simple meta-training strategies that require minimal computational resources, (c) matches accuracy-wise SOTA hand-designed optimizers with carefully tuned hyper-parameters (often producing top performing models). Furthermore, Mnemosyne provides space complexity comparable to that of its hand-designed first-order counterparts, which allows it to scale to training larger sets of parameters. We conduct an extensive empirical evaluation of Mnemosyne on: (a) fine-tuning a wide range of Vision Transformers (ViTs) from medium-size architectures to massive ViT-Hs (36 layers, 16 heads), (b) pre-training BERT models and (c) soft prompt-tuning large 11B+ T5XXL models. We complement our results with a comprehensive theoretical analysis of the compact associative memory used by Mnemosyne which we believe was never done before.
Metaverse: Requirements, Architecture, Standards, Status, Challenges, and Perspectives
Authors: Danda B Rawat, Hassan El alami
Date: 2023-02-02 00:00:00

The Metaverse is driving the next wave of innovation for new opportunities by replacing the digital world (Internet) with the virtual world through a single, shared, immersive, persistent 3D virtual space. In this paper, we present requirements, architecture, standards, challenges, and solutions for Metaverse. Specifically, we provide Metaverse architecture and requirements, and different standards for Metaverse which serve as the basis for the development and deployment. Moreover, we present recent status, challenges such as integration of AI and Metaverse, security and privacy in Metaverse, etc., and perspectives and solutions.
A Survey on Efficient Training of Transformers
Authors: Bohan Zhuang, Jing Liu, Zizheng Pan, Haoyu He, Yuetian Weng, Chunhua Shen
Date: 2023-02-02 00:00:00
Tasks: Survey

Recent advances in Transformers have come with a huge requirement on computing resources, highlighting the importance of developing efficient training techniques to make Transformer training faster, at lower cost, and to higher accuracy by the efficient use of computation and memory resources. This survey provides the first systematic overview of the efficient training of Transformers, covering the recent progress in acceleration arithmetic and hardware, with a focus on the former. We analyze and compare methods that save computation and memory costs for intermediate tensors during training, together with techniques on hardware/algorithm co-design. We finally discuss challenges and promising areas for future research.
LesionAid: Vision Transformers-based Skin Lesion Generation and Classification
Authors: Ghanta Sai Krishna, Kundrapu Supriya, Mallikharjuna Rao K, Meetiksha Sorgile
Date: 2023-02-02 00:00:00
Tasks: Classification, Data Augmentation, Edge-computing, Explainable Artificial Intelligence (XAI), Lesion Detection

Skin cancer is one of the most prevalent forms of human cancer. It is recognized mainly visually, beginning with clinical screening and continuing with the dermoscopic examination, histological assessment, and specimen collection. Deep convolutional neural networks (CNNs) perform highly segregated and potentially universal tasks against a classified finegrained object. This research proposes a novel multi-class prediction framework that classifies skin lesions based on ViT and ViTGAN. Vision transformers-based GANs (Generative Adversarial Networks) are utilized to tackle the class imbalance. The framework consists of four main phases: ViTGANs, Image processing, and explainable AI. Phase 1 consists of generating synthetic images to balance all the classes in the dataset. Phase 2 consists of applying different data augmentation techniques and morphological operations to increase the size of the data. Phases 3 & 4 involve developing a ViT model for edge computing systems that can identify patterns and categorize skin lesions from the user's skin visible in the image. In phase 3, after classifying the lesions into the desired class with ViT, we will use explainable AI (XAI) that leads to more explainable results (using activation maps, etc.) while ensuring high predictive accuracy. Real-time images of skin diseases can capture by a doctor or a patient using the camera of a mobile application to perform an early examination and determine the cause of the skin lesion. The whole framework is compared with the existing frameworks for skin lesion detection.
A general Markov decision process formalism for action-state entropy-regularized reward maximization
Authors: Dmytro Grytskyy, Jorge Ramírez-Ruiz, Rubén Moreno-Bote
Date: 2023-02-02 00:00:00

Previous work has separately addressed different forms of action, state and action-state entropy regularization, pure exploration and space occupation. These problems have become extremely relevant for regularization, generalization, speeding up learning and providing robust solutions at unprecedented levels. However, solutions of those problems are hectic, ranging from convex and non-convex optimization, and unconstrained optimization to constrained optimization. Here we provide a general dual function formalism that transforms the constrained optimization problem into an unconstrained convex one for any mixture of action and state entropies. The cases with pure action entropy and pure state entropy are understood as limits of the mixture.
NFRsTDO v1.2's Terms, Properties, and Relationships -- A Top-Domain Non-Functional Requirements Ontology
Authors: Luis Olsina, María Fernanda Papa, Pablo Becker
Date: 2023-02-02 00:00:00

This preprint specifies and defines all the Terms, Properties, and Relationships of NFRsTDO (Non-Functional Requirements Top-Domain Ontology). NFRsTDO v1.2, whose UML conceptualization is shown in Figure 1 is a slightly updated version of its predecessor, namely NFRsTDO v1.1. NFRsTDO is an ontology mainly devoted to quality (non-functional) requirements and quality/cost views, which is placed at the top-domain level in the context of a multilayer ontological architecture called FCD-OntoArch (Foundational, Core, Domain, and instance Ontological Architecture for sciences). Figure 2 depicts its five tiers, which entail Foundational, Core, Top-Domain, Low-Domain, and Instance. Each level is populated with ontological components or, in other words, ontologies. Ontologies at the same level can be related to each other, except at the foundational level, where only ThingFO (Thing Foundational Ontology) is found. In addition, ontologies' terms and relationships at lower levels can be semantically enriched by ontologies' terms and relationships from the higher levels. NFRsTDO's terms and relationships are mainly extended/reused from ThingFO, SituationCO (Situation Core Ontology), ProcessCO (Process Core Ontology), and FRsTDO (Functional Requirements Top-Domain Ontology). Stereotypes are the used mechanism for enriching NFRsTDO terms. Note that annotations of updates from the previous version (NFRsTDO v1.1) to the current one (v1.2) can be found in Appendix A.
A Survey on Compositional Generalization in Applications
Authors: Baihan Lin, Djallel Bouneffouf, Irina Rish
Date: 2023-02-02 00:00:00
Tasks: Survey

The field of compositional generalization is currently experiencing a renaissance in AI, as novel problem settings and algorithms motivated by various practical applications are being introduced, building on top of the classical compositional generalization problem. This article aims to provide a comprehensive review of top recent developments in multiple real-life applications of the compositional generalization. Specifically, we introduce a taxonomy of common applications and summarize the state-of-the-art for each of those domains. Furthermore, we identify important current trends and provide new perspectives pertaining to the future of this burgeoning field.
MLOps with enhanced performance control and observability
Authors: Indradumna Banerjee, Dinesh Ghanta, Girish Nautiyal, Pradeep Sanchana, Prateek Katageri, Atin Modi
Date: 2023-02-02 00:00:00
Tasks: Model Selection

The explosion of data and its ever increasing complexity in the last few years, has made MLOps systems more prone to failure, and new tools need to be embedded in such systems to avoid such failure. In this demo, we will introduce crucial tools in the observability module of a MLOps system that target difficult issues like data drfit and model version control for optimum model selection. We believe integrating these features in our MLOps pipeline would go a long way in building a robust system immune to early stage ML system failures.
Real-Time Evaluation in Online Continual Learning: A New Hope
Authors: Yasir Ghunaim, Adel Bibi, Kumail Alhamoud, Motasem Alfarra, Hasan Abed Al Kader Hammoud, Ameya Prabhu, Philip H. S. Torr, Bernard Ghanem
Date: 2023-02-02 00:00:00
Proceeding: CVPR 2023 1
Tasks: Continual Learning

Current evaluations of Continual Learning (CL) methods typically assume that there is no constraint on training time and computation. This is an unrealistic assumption for any real-world setting, which motivates us to propose: a practical real-time evaluation of continual learning, in which the stream does not wait for the model to complete training before revealing the next data for predictions. To do this, we evaluate current CL methods with respect to their computational costs. We conduct extensive experiments on CLOC, a large-scale dataset containing 39 million time-stamped images with geolocation labels. We show that a simple baseline outperforms state-of-the-art CL methods under this evaluation, questioning the applicability of existing methods in realistic settings. In addition, we explore various CL components commonly used in the literature, including memory sampling strategies and regularization approaches. We find that all considered methods fail to be competitive against our simple baseline. This surprisingly suggests that the majority of existing CL literature is tailored to a specific class of streams that is not practical. We hope that the evaluation we provide will be the first step towards a paradigm shift to consider the computational cost in the development of online continual learning methods.
TAPS Responsibility Matrix: A tool for responsible data science by design
Authors: Visara Urovi, Remzi Celebi, Chang Sun, Linda Rieswijk, Michael Erard, Arif Yilmaz, Kody Moodley, Parveen Kumar, Michel Dumontier
Date: 2023-02-02 00:00:00
Tasks: Management

Data science is an interdisciplinary research area where scientists are typically working with data coming from different fields. When using and analyzing data, the scientists implicitly agree to follow standards, procedures, and rules set in these fields. However, guidance on the responsibilities of the data scientists and the other involved actors in a data science project is typically missing. While literature shows that novel frameworks and tools are being proposed in support of open-science, data reuse, and research data management, there are currently no frameworks that can fully express responsibilities of a data science project. In this paper, we describe the Transparency, Accountability, Privacy, and Societal Responsibility Matrix (TAPS-RM) as framework to explore social, legal, and ethical aspects of data science projects. TAPS-RM acts as a tool to provide users with a holistic view of their project beyond key outcomes and clarifies the responsibilities of actors. We map the developed model of TAPS-RM with well-known initiatives for open data (such as FACT, FAIR and Datasheets for datasets). We conclude that TAPS-RM is a tool to reflect on responsibilities at a data science project level and can be used to advance responsible data science by design.
Semantic Coherence Markers for the Early Diagnosis of the Alzheimer Disease
Authors: Davide Colla, Matteo Delsanto, Marco Agosto, Benedetto Vitiello, Daniele Paolo Radicioni
Date: 2023-02-02 00:00:00
Tasks: Language Modeling, Language Modelling, Specificity

In this work we explore how language models can be employed to analyze language and discriminate between mentally impaired and healthy subjects through the perplexity metric. Perplexity was originally conceived as an information-theoretic measure to assess how much a given language model is suited to predict a text sequence or, equivalently, how much a word sequence fits into a specific language model. We carried out an extensive experimentation with the publicly available data, and employed language models as diverse as N-grams, from 2-grams to 5-grams, and GPT-2, a transformer-based language model. We investigated whether perplexity scores may be used to discriminate between the transcripts of healthy subjects and subjects suffering from Alzheimer Disease (AD). Our best performing models achieved full accuracy and F-score (1.00 in both precision/specificity and recall/sensitivity) in categorizing subjects from both the AD class and control subjects. These results suggest that perplexity can be a valuable analytical metrics with potential application to supporting early diagnosis of symptoms of mental disorders.
Meta Learning in Decentralized Neural Networks: Towards More General AI
Authors: Yuwei Sun
Date: 2023-02-02 00:00:00
Tasks: Meta-Learning

Meta-learning usually refers to a learning algorithm that learns from other learning algorithms. The problem of uncertainty in the predictions of neural networks shows that the world is only partially predictable and a learned neural network cannot generalize to its ever-changing surrounding environments. Therefore, the question is how a predictive model can represent multiple predictions simultaneously. We aim to provide a fundamental understanding of learning to learn in the contents of Decentralized Neural Networks (Decentralized NNs) and we believe this is one of the most important questions and prerequisites to building an autonomous intelligence machine. To this end, we shall demonstrate several pieces of evidence for tackling the problems above with Meta Learning in Decentralized NNs. In particular, we will present three different approaches to building such a decentralized learning system: (1) learning from many replica neural networks, (2) building the hierarchy of neural networks for different functions, and (3) leveraging different modality experts to learn cross-modal representations.
Graph Neural Networks for temporal graphs: State of the art, open challenges, and opportunities
Authors: Antonio Longa, Veronica Lachi, Gabriele Santin, Monica Bianchini, Bruno Lepri, Pietro Lio, Franco Scarselli, Andrea Passerini
Date: 2023-02-02 00:00:00

Graph Neural Networks (GNNs) have become the leading paradigm for learning on (static) graph-structured data. However, many real-world systems are dynamic in nature, since the graph and node/edge attributes change over time. In recent years, GNN-based models for temporal graphs have emerged as a promising area of research to extend the capabilities of GNNs. In this work, we provide the first comprehensive overview of the current state-of-the-art of temporal GNN, introducing a rigorous formalization of learning settings and tasks and a novel taxonomy categorizing existing approaches in terms of how the temporal aspect is represented and processed. We conclude the survey with a discussion of the most relevant open challenges for the field, from both research and application perspectives.
Predefined domain specific embeddings of food concepts and recipes: A case study on heterogeneous recipe datasets
Authors: Gordana Ispirova, Tome Eftimov, Barbara Koroušić Seljak
Date: 2023-02-02 00:00:00
Tasks: named-entity-recognition, Named Entity Recognition, Named Entity Recognition (NER), NER

Although recipe data are very easy to come by nowadays, it is really hard to find a complete recipe dataset - with a list of ingredients, nutrient values per ingredient, and per recipe, allergens, etc. Recipe datasets are usually collected from social media websites where users post and publish recipes. Usually written with little to no structure, using both standardized and non-standardized units of measurement. We collect six different recipe datasets, publicly available, in different formats, and some including data in different languages. Bringing all of these datasets to the needed format for applying a machine learning (ML) pipeline for nutrient prediction [1], [2], includes data normalization using dictionary-based named entity recognition (NER), rule-based NER, as well as conversions using external domain-specific resources. From the list of ingredients, domain-specific embeddings are created using the same embedding space for all recipes - one ingredient dataset is generated. The result from this normalization process is two corpora - one with predefined ingredient embeddings and one with predefined recipe embeddings. On all six recipe datasets, the ML pipeline is evaluated. The results from this use case also confirm that the embeddings merged using the domain heuristic yield better results than the baselines.
Physics Informed Piecewise Linear Neural Networks for Process Optimization
Authors: Ece S. Koksal, Erdal Aydin
Date: 2023-02-02 00:00:00
Tasks: CPU

Constructing first-principles models is usually a challenging and time-consuming task due to the complexity of the real-life processes. On the other hand, data-driven modeling, and in particular neural network models often suffer from issues such as overfitting and lack of useful and highquality data. At the same time, embedding trained machine learning models directly into the optimization problems has become an effective and state-of-the-art approach for surrogate optimization, whose performance can be improved by physics-informed training. In this study, it is proposed to upgrade piece-wise linear neural network models with physics informed knowledge for optimization problems with neural network models embedded. In addition to using widely accepted and naturally piece-wise linear rectified linear unit (ReLU) activation functions, this study also suggests piece-wise linear approximations for the hyperbolic tangent activation function to widen the domain. Optimization of three case studies, a blending process, an industrial distillation column and a crude oil column are investigated. For all cases, physics-informed trained neural network based optimal results are closer to global optimality. Finally, associated CPU times for the optimization problems are much shorter than the standard optimization results.
Eloss in the way: A Sensitive Input Quality Metrics for Intelligent Driving
Authors: Haobo Yang, Shiyan Zhang, Zhuoyi Yang, Xinyu Zhang
Date: 2023-02-02 00:00:00
Tasks: 3D Object Detection, Anomaly Detection

With the increasing complexity of the traffic environment, the importance of safety perception in intelligent driving is growing. Conventional methods in the robust perception of intelligent driving focus on training models with anomalous data, letting the deep neural network decide how to tackle anomalies. However, these models cannot adapt smoothly to the diverse and complex real-world environment. This paper proposes a new type of metric known as Eloss and offers a novel training strategy to empower perception models from the aspect of anomaly detection. Eloss is designed based on an explanation of the perception model's information compression layers. Specifically, taking inspiration from the design of a communication system, the information transmission process of an information compression network has two expectations: the amount of information changes steadily, and the information entropy continues to decrease. Then Eloss can be obtained according to the above expectations, guiding the update of related network parameters and producing a sensitive metric to identify anomalies while maintaining the model performance. Our experiments demonstrate that Eloss can deviate from the standard value by a factor over 100 with anomalous data and produce distinctive values for similar but different types of anomalies, showing the effectiveness of the proposed method. Our code is available at: (code available after paper accepted).