Statistical shape modeling (SSM) is an essential tool for analyzing variations in anatomical morphology. In a typical SSM pipeline, 3D anatomical images, gone through segmentation and rigid registration, are represented using lower-dimensional shape features, on which statistical analysis can be performed. Various methods for constructing compact shape representations have been proposed, but they involve laborious and costly steps. We propose Image2SSM, a novel deep-learning-based approach for SSM that leverages image-segmentation pairs to learn a radial-basis-function (RBF)-based representation of shapes directly from images. This RBF-based shape representation offers a rich self-supervised signal for the network to estimate a continuous, yet compact representation of the underlying surface that can adapt to complex geometries in a data-driven manner. Image2SSM can characterize populations of biological structures of interest by constructing statistical landmark-based shape models of ensembles of anatomical shapes while requiring minimal parameter tuning and no user assistance. Once trained, Image2SSM can be used to infer low-dimensional shape representations from new unsegmented images, paving the way toward scalable approaches for SSM, especially when dealing with large cohorts. Experiments on synthetic and real datasets show the efficacy of the proposed method compared to the state-of-art correspondence-based method for SSM.
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Semi-Supervised Learning (SSL) aims to learn a model using a tiny labeled set and massive amounts of unlabeled data. To better exploit the unlabeled data the latest SSL methods use pseudo-labels predicted from a single discriminative classifier. However, the generated pseudo-labels are inevitably linked to inherent confirmation bias and noise which greatly affects the model performance. In this work we introduce a new framework for SSL named NorMatch. Firstly, we introduce a new uncertainty estimation scheme based on normalizing flows, as an auxiliary classifier, to enforce highly certain pseudo-labels yielding a boost of the discriminative classifiers. Secondly, we introduce a threshold-free sample weighting strategy to exploit better both high and low confidence pseudo-labels. Furthermore, we utilize normalizing flows to model, in an unsupervised fashion, the distribution of unlabeled data. This modelling assumption can further improve the performance of generative classifiers via unlabeled data, and thus, implicitly contributing to training a better discriminative classifier. We demonstrate, through numerical and visual results, that NorMatch achieves state-of-the-art performance on several datasets.
This study pioneers the use of synthetically generated data for training generative models in document-level text simplification of German texts. We demonstrate the effectiveness of our approach with real-world online texts. Addressing the challenge of data scarcity in language simplification, we crawled professionally simplified German texts and synthesized a corpus using GPT-4. We finetune Large Language Models with up to 13 billion parameters on this data and evaluate their performance. This paper employs various methodologies for evaluation and demonstrates the limitations of currently used rule-based metrics. Both automatic and manual evaluations reveal that our models can significantly simplify real-world online texts, indicating the potential of synthetic data in improving text simplification.
Graph partitioning aims to divide a graph into disjoint subsets while optimizing a specific partitioning objective. The majority of formulations related to graph partitioning exhibit NP-hardness due to their combinatorial nature. Conventional methods, like approximation algorithms or heuristics, are designed for distinct partitioning objectives and fail to achieve generalization across other important partitioning objectives. Recently machine learning-based methods have been developed that learn directly from data. Further, these methods have a distinct advantage of utilizing node features that carry additional information. However, these methods assume differentiability of target partitioning objective functions and cannot generalize for an unknown number of partitions, i.e., they assume the number of partitions is provided in advance. In this study, we develop NeuroCUT with two key innovations over previous methodologies. First, by leveraging a reinforcement learning-based framework over node representations derived from a graph neural network and positional features, NeuroCUT can accommodate any optimization objective, even those with non-differentiable functions. Second, we decouple the parameter space and the partition count making NeuroCUT inductive to any unseen number of partition, which is provided at query time. Through empirical evaluation, we demonstrate that NeuroCUT excels in identifying high-quality partitions, showcases strong generalization across a wide spectrum of partitioning objectives, and exhibits strong generalization to unseen partition count.
Low-Rank Adaptation (LoRA) provides an effective yet efficient solution for fine-tuning large language models (LLM). The modular and plug-and-play nature of LoRA enables the integration of diverse domain-specific LoRAs to enhance the capabilities of LLMs. Previous research on exploiting multiple LoRAs either focuses on specific isolated downstream tasks or fixes the selection of LoRAs during training. However, in real-world scenarios, LLMs receive diverse prompts covering different tasks, and the pool of candidate LoRAs is often dynamically updated. To bridge this gap, we propose LoraRetriever, a retrieve-then-compose framework that adaptively retrieves and composes multiple LoRAs according to the input prompts. LoraRetriever contains three main components: firstly, identifying and retrieving LoRAs relevant to the given input; secondly, formulating strategies for effectively integrating the retrieved LoRAs; and thirdly, developing efficient batch inference to accommodate heterogeneous requests. Experimental results indicate that LoraRetriever consistently outperforms the baselines, highlighting its practical effectiveness and versatility.
In Federated Learning (FL), a framework to train machine learning models across distributed data, well-known algorithms like FedAvg tend to have slow convergence rates, resulting in high communication costs during training. To address this challenge, we introduce FedLion, an adaptive federated optimization algorithm that seamlessly incorporates key elements from the recently proposed centralized adaptive algorithm, Lion (Chen et al. 2o23), into the FL framework. Through comprehensive evaluations on two widely adopted FL benchmarks, we demonstrate that FedLion outperforms previous state-of-the-art adaptive algorithms, including FAFED (Wu et al. 2023) and FedDA. Moreover, thanks to the use of signed gradients in local training, FedLion substantially reduces data transmission requirements during uplink communication when compared to existing adaptive algorithms, further reducing communication costs. Last but not least, this work also includes a novel theoretical analysis, showcasing that FedLion attains faster convergence rate than established FL algorithms like FedAvg.
Exponential Moving Average (EMA) is a widely used weight averaging (WA) regularization to learn flat optima for better generalizations without extra cost in deep neural network (DNN) optimization. Despite achieving better flatness, existing WA methods might fall into worse final performances or require extra test-time computations. This work unveils the full potential of EMA with a single line of modification, i.e., switching the EMA parameters to the original model after each epoch, dubbed as Switch EMA (SEMA). From both theoretical and empirical aspects, we demonstrate that SEMA can help DNNs to reach generalization optima that better trade-off between flatness and sharpness. To verify the effectiveness of SEMA, we conduct comparison experiments with discriminative, generative, and regression tasks on vision and language datasets, including image classification, self-supervised learning, object detection and segmentation, image generation, video prediction, attribute regression, and language modeling. Comprehensive results with popular optimizers and networks show that SEMA is a free lunch for DNN training by improving performances and boosting convergence speeds.
Effective DNA embedding remains crucial in genomic analysis, particularly in scenarios lacking labeled data for model fine-tuning, despite the significant advancements in genome foundation models. A prime example is metagenomics binning, a critical process in microbiome research that aims to group DNA sequences by their species from a complex mixture of DNA sequences derived from potentially thousands of distinct, often uncharacterized species. To fill the lack of effective DNA embedding models, we introduce DNABERT-S, a genome foundation model that specializes in creating species-aware DNA embeddings. To encourage effective embeddings to error-prone long-read DNA sequences, we introduce Manifold Instance Mixup (MI-Mix), a contrastive objective that mixes the hidden representations of DNA sequences at randomly selected layers and trains the model to recognize and differentiate these mixed proportions at the output layer. We further enhance it with the proposed Curriculum Contrastive Learning (C$^2$LR) strategy. Empirical results on 18 diverse datasets showed DNABERT-S's remarkable performance. It outperforms the top baseline's performance in 10-shot species classification with just a 2-shot training while doubling the Adjusted Rand Index (ARI) in species clustering and substantially increasing the number of correctly identified species in metagenomics binning. The code, data, and pre-trained model are publicly available at //github.com/Zhihan1996/DNABERT_S.
The existence of representative datasets is a prerequisite of many successful artificial intelligence and machine learning models. However, the subsequent application of these models often involves scenarios that are inadequately represented in the data used for training. The reasons for this are manifold and range from time and cost constraints to ethical considerations. As a consequence, the reliable use of these models, especially in safety-critical applications, is a huge challenge. Leveraging additional, already existing sources of knowledge is key to overcome the limitations of purely data-driven approaches, and eventually to increase the generalization capability of these models. Furthermore, predictions that conform with knowledge are crucial for making trustworthy and safe decisions even in underrepresented scenarios. This work provides an overview of existing techniques and methods in the literature that combine data-based models with existing knowledge. The identified approaches are structured according to the categories integration, extraction and conformity. Special attention is given to applications in the field of autonomous driving.
Deep learning has shown great potential for modeling the physical dynamics of complex particle systems such as fluids (in Lagrangian descriptions). Existing approaches, however, require the supervision of consecutive particle properties, including positions and velocities. In this paper, we consider a partially observable scenario known as fluid dynamics grounding, that is, inferring the state transitions and interactions within the fluid particle systems from sequential visual observations of the fluid surface. We propose a differentiable two-stage network named NeuroFluid. Our approach consists of (i) a particle-driven neural renderer, which involves fluid physical properties into the volume rendering function, and (ii) a particle transition model optimized to reduce the differences between the rendered and the observed images. NeuroFluid provides the first solution to unsupervised learning of particle-based fluid dynamics by training these two models jointly. It is shown to reasonably estimate the underlying physics of fluids with different initial shapes, viscosity, and densities. It is a potential alternative approach to understanding complex fluid mechanics, such as turbulence, that are difficult to model using traditional methods of mathematical physics.
TransMIL: Transformer based Correlated Multiple Instance Learning for Whole Slide Image Classication
Multiple instance learning (MIL) is a powerful tool to solve the weakly supervised classification in whole slide image (WSI) based pathology diagnosis. However, the current MIL methods are usually based on independent and identical distribution hypothesis, thus neglect the correlation among different instances. To address this problem, we proposed a new framework, called correlated MIL, and provided a proof for convergence. Based on this framework, we devised a Transformer based MIL (TransMIL), which explored both morphological and spatial information. The proposed TransMIL can effectively deal with unbalanced/balanced and binary/multiple classification with great visualization and interpretability. We conducted various experiments for three different computational pathology problems and achieved better performance and faster convergence compared with state-of-the-art methods. The test AUC for the binary tumor classification can be up to 93.09% over CAMELYON16 dataset. And the AUC over the cancer subtypes classification can be up to 96.03% and 98.82% over TCGA-NSCLC dataset and TCGA-RCC dataset, respectively.
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