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Influence Maximization (IM) is a crucial problem in data science. The goal is to find a fixed-size set of highly-influential seed vertices on a network to maximize the influence spread along the edges. While IM is NP-hard on commonly-used diffusion models, a greedy algorithm can achieve $(1-1/e)$-approximation, repeatedly selecting the vertex with the highest marginal gain in influence as the seed. Due to theoretical guarantees, rich literature focuses on improving the performance of the greedy algorithm. To estimate the marginal gain, existing work either runs Monte Carlo (MC) simulations of influence spread or pre-stores hundreds of sketches (usually per-vertex information). However, these approaches can be inefficient in time (MC simulation) or space (storing sketches), preventing the ideas from scaling to today's large-scale graphs. This paper significantly improves the scalability of IM using two key techniques. The first is a sketch-compression technique for the independent cascading model on undirected graphs. It allows combining the simulation and sketching approaches to achieve a time-space tradeoff. The second technique includes new data structures for parallel seed selection. Using our new approaches, we implemented PaC-IM: Parallel and Compressed IM. We compare PaC-IM with state-of-the-art parallel IM systems on a 96-core machine with 1.5TB memory. PaC-IM can process large-scale graphs with up to 900M vertices and 74B edges in about 2 hours. On average across all tested graphs, our uncompressed version is 5--18$\times$ faster and about 1.4$\times$ more space-efficient than existing parallel IM systems. Using compression further saves 3.8$\times$ space with only 70% overhead in time on average.

GFlowNets are probabilistic models that sequentially generate compositional structures through a stochastic policy. Among GFlowNets, temperature-conditional GFlowNets can introduce temperature-based controllability for exploration and exploitation. We propose \textit{Logit-scaling GFlowNets} (Logit-GFN), a novel architectural design that greatly accelerates the training of temperature-conditional GFlowNets. It is based on the idea that previously proposed approaches introduced numerical challenges in the deep network training, since different temperatures may give rise to very different gradient profiles as well as magnitudes of the policy's logits. We find that the challenge is greatly reduced if a learned function of the temperature is used to scale the policy's logits directly. Also, using Logit-GFN, GFlowNets can be improved by having better generalization capabilities in offline learning and mode discovery capabilities in online learning, which is empirically verified in various biological and chemical tasks. Our code is available at \url{//github.com/dbsxodud-11/logit-gfn}

Unsupervised learning aims to capture the underlying structure of potentially large and high-dimensional datasets. Traditionally, this involves using dimensionality reduction methods to project data onto interpretable spaces or organizing points into meaningful clusters. In practice, these methods are used sequentially, without guaranteeing that the clustering aligns well with the conducted dimensionality reduction. In this work, we offer a fresh perspective: that of distributions. Leveraging tools from optimal transport, particularly the Gromov-Wasserstein distance, we unify clustering and dimensionality reduction into a single framework called distributional reduction. This allows us to jointly address clustering and dimensionality reduction with a single optimization problem. Through comprehensive experiments, we highlight the versatility and interpretability of our method and show that it outperforms existing approaches across a variety of image and genomics datasets.

Pre-trained language models (LMs) perform well in In-Topic setups, where training and testing data come from the same topics. However, they face challenges in Cross-Topic scenarios where testing data is derived from distinct topics -- such as Gun Control. This study analyzes various LMs with three probing-based experiments to shed light on the reasons behind the In- vs. Cross-Topic generalization gap. Thereby, we demonstrate, for the first time, that generalization gaps and the robustness of the embedding space vary significantly across LMs. Additionally, we assess larger LMs and underscore the relevance of our analysis for recent models. Overall, diverse pre-training objectives, architectural regularization, or data deduplication contribute to more robust LMs and diminish generalization gaps. Our research contributes to a deeper understanding and comparison of language models across different generalization scenarios.

Machine Learning (ML) has demonstrated its great potential on medical data analysis. Large datasets collected from diverse sources and settings are essential for ML models in healthcare to achieve better accuracy and generalizability. Sharing data across different healthcare institutions is challenging because of complex and varying privacy and regulatory requirements. Hence, it is hard but crucial to allow multiple parties to collaboratively train an ML model leveraging the private datasets available at each party without the need for direct sharing of those datasets or compromising the privacy of the datasets through collaboration. In this paper, we address this challenge by proposing Decentralized, Collaborative, and Privacy-preserving ML for Multi-Hospital Data (DeCaPH). It offers the following key benefits: (1) it allows different parties to collaboratively train an ML model without transferring their private datasets; (2) it safeguards patient privacy by limiting the potential privacy leakage arising from any contents shared across the parties during the training process; and (3) it facilitates the ML model training without relying on a centralized server. We demonstrate the generalizability and power of DeCaPH on three distinct tasks using real-world distributed medical datasets: patient mortality prediction using electronic health records, cell-type classification using single-cell human genomes, and pathology identification using chest radiology images. We demonstrate that the ML models trained with DeCaPH framework have an improved utility-privacy trade-off, showing it enables the models to have good performance while preserving the privacy of the training data points. In addition, the ML models trained with DeCaPH framework in general outperform those trained solely with the private datasets from individual parties, showing that DeCaPH enhances the model generalizability.

Large language models (LLMs) are proficient at generating fluent text with minimal task-specific supervision. Yet, their ability to provide well-grounded rationalizations for knowledge-intensive tasks remains under-explored. Such tasks, like commonsense multiple-choice questions, require rationales based on world knowledge to support predictions and refute alternate options. We consider the task of generating knowledge-guided rationalization in natural language by using expert-written examples in a few-shot manner. Surprisingly, crowd-workers preferred knowledge-grounded rationales over crowdsourced rationalizations, citing their factuality, sufficiency, and comprehensive refutations. Although LLMs-generated rationales were preferable, further improvements in conciseness and novelty are required. In another study, we show how rationalization of incorrect model predictions erodes humans' trust in LLM-generated rationales. Motivated by these observations, we create a two-stage pipeline to review task predictions and eliminate potential incorrect decisions before rationalization, enabling trustworthy rationale generation.

Pre-trained Language Models (PLMs) which are trained on large text corpus via self-supervised learning method, have yielded promising performance on various tasks in Natural Language Processing (NLP). However, though PLMs with huge parameters can effectively possess rich knowledge learned from massive training text and benefit downstream tasks at the fine-tuning stage, they still have some limitations such as poor reasoning ability due to the lack of external knowledge. Research has been dedicated to incorporating knowledge into PLMs to tackle these issues. In this paper, we present a comprehensive review of Knowledge-Enhanced Pre-trained Language Models (KE-PLMs) to provide a clear insight into this thriving field. We introduce appropriate taxonomies respectively for Natural Language Understanding (NLU) and Natural Language Generation (NLG) to highlight these two main tasks of NLP. For NLU, we divide the types of knowledge into four categories: linguistic knowledge, text knowledge, knowledge graph (KG), and rule knowledge. The KE-PLMs for NLG are categorized into KG-based and retrieval-based methods. Finally, we point out some promising future directions of KE-PLMs.

Human-in-the-loop aims to train an accurate prediction model with minimum cost by integrating human knowledge and experience. Humans can provide training data for machine learning applications and directly accomplish some tasks that are hard for computers in the pipeline with the help of machine-based approaches. In this paper, we survey existing works on human-in-the-loop from a data perspective and classify them into three categories with a progressive relationship: (1) the work of improving model performance from data processing, (2) the work of improving model performance through interventional model training, and (3) the design of the system independent human-in-the-loop. Using the above categorization, we summarize major approaches in the field, along with their technical strengths/ weaknesses, we have simple classification and discussion in natural language processing, computer vision, and others. Besides, we provide some open challenges and opportunities. This survey intends to provide a high-level summarization for human-in-the-loop and motivates interested readers to consider approaches for designing effective human-in-the-loop solutions.

The recent proliferation of knowledge graphs (KGs) coupled with incomplete or partial information, in the form of missing relations (links) between entities, has fueled a lot of research on knowledge base completion (also known as relation prediction). Several recent works suggest that convolutional neural network (CNN) based models generate richer and more expressive feature embeddings and hence also perform well on relation prediction. However, we observe that these KG embeddings treat triples independently and thus fail to cover the complex and hidden information that is inherently implicit in the local neighborhood surrounding a triple. To this effect, our paper proposes a novel attention based feature embedding that captures both entity and relation features in any given entity's neighborhood. Additionally, we also encapsulate relation clusters and multihop relations in our model. Our empirical study offers insights into the efficacy of our attention based model and we show marked performance gains in comparison to state of the art methods on all datasets.