Max Planck Institute for Intelligent Systems




Abstract:Domain Generalization (DG) endeavors to create machine learning models that excel in unseen scenarios by learning invariant features. In DG, the prevalent practice of constraining models to a fixed structure or uniform parameterization to encapsulate invariant features can inadvertently blend specific aspects. Such an approach struggles with nuanced differentiation of inter-domain variations and may exhibit bias towards certain domains, hindering the precise learning of domain-invariant features. Recognizing this, we introduce a novel method designed to supplement the model with domain-level and task-specific characteristics. This approach aims to guide the model in more effectively separating invariant features from specific characteristics, thereby boosting the generalization. Building on the emerging trend of visual prompts in the DG paradigm, our work introduces the novel \textbf{H}ierarchical \textbf{C}ontrastive \textbf{V}isual \textbf{P}rompt (HCVP) methodology. This represents a significant advancement in the field, setting itself apart with a unique generative approach to prompts, alongside an explicit model structure and specialized loss functions. Differing from traditional visual prompts that are often shared across entire datasets, HCVP utilizes a hierarchical prompt generation network enhanced by prompt contrastive learning. These generative prompts are instance-dependent, catering to the unique characteristics inherent to different domains and tasks. Additionally, we devise a prompt modulation network that serves as a bridge, effectively incorporating the generated visual prompts into the vision transformer backbone. Experiments conducted on five DG datasets demonstrate the effectiveness of HCVP, outperforming both established DG algorithms and adaptation protocols.
Abstract:In causal discovery, non-Gaussianity has been used to characterize the complete configuration of a Linear Non-Gaussian Acyclic Model (LiNGAM), encompassing both the causal ordering of variables and their respective connection strengths. However, LiNGAM can only deal with the finite-dimensional case. To expand this concept, we extend the notion of variables to encompass vectors and even functions, leading to the Functional Linear Non-Gaussian Acyclic Model (Func-LiNGAM). Our motivation stems from the desire to identify causal relationships in brain-effective connectivity tasks involving, for example, fMRI and EEG datasets. We demonstrate why the original LiNGAM fails to handle these inherently infinite-dimensional datasets and explain the availability of functional data analysis from both empirical and theoretical perspectives. {We establish theoretical guarantees of the identifiability of the causal relationship among non-Gaussian random vectors and even random functions in infinite-dimensional Hilbert spaces.} To address the issue of sparsity in discrete time points within intrinsic infinite-dimensional functional data, we propose optimizing the coordinates of the vectors using functional principal component analysis. Experimental results on synthetic data verify the ability of the proposed framework to identify causal relationships among multivariate functions using the observed samples. For real data, we focus on analyzing the brain connectivity patterns derived from fMRI data.




Abstract:Financial data is generally time series in essence and thus suffers from three fundamental issues: the mismatch in time resolution, the time-varying property of the distribution - nonstationarity, and causal factors that are important but unknown/unobserved. In this paper, we follow a causal perspective to systematically look into these three demons in finance. Specifically, we reexamine these issues in the context of causality, which gives rise to a novel and inspiring understanding of how the issues can be addressed. Following this perspective, we provide systematic solutions to these problems, which hopefully would serve as a foundation for future research in the area.




Abstract:In order to predict a pedestrian's trajectory in a crowd accurately, one has to take into account her/his underlying socio-temporal interactions with other pedestrians consistently. Unlike existing work that represents the relevant information separately, partially, or implicitly, we propose a complete representation for it to be fully and explicitly captured and analyzed. In particular, we introduce a Directed Acyclic Graph-based structure, which we term Socio-Temporal Graph (STG), to explicitly capture pair-wise socio-temporal interactions among a group of people across both space and time. Our model is built on a time-varying generative process, whose latent variables determine the structure of the STGs. We design an attention-based model named STGformer that affords an end-to-end pipeline to learn the structure of the STGs for trajectory prediction. Our solution achieves overall state-of-the-art prediction accuracy in two large-scale benchmark datasets. Our analysis shows that a person's past trajectory is critical for predicting another person's future path. Our model learns this relationship with a strong notion of socio-temporal localities. Statistics show that utilizing this information explicitly for prediction yields a noticeable performance gain with respect to the trajectory-only approaches.




Abstract:Causal discovery with latent variables is a crucial but challenging task. Despite the emergence of numerous methods aimed at addressing this challenge, they are not fully identified to the structure that two observed variables are influenced by one latent variable and there might be a directed edge in between. Interestingly, we notice that this structure can be identified through the utilization of higher-order cumulants. By leveraging the higher-order cumulants of non-Gaussian data, we provide an analytical solution for estimating the causal coefficients or their ratios. With the estimated (ratios of) causal coefficients, we propose a novel approach to identify the existence of a causal edge between two observed variables subject to latent variable influence. In case when such a causal edge exits, we introduce an asymmetry criterion to determine the causal direction. The experimental results demonstrate the effectiveness of our proposed method.




Abstract:Most existing causal discovery methods rely on the assumption of no latent confounders, limiting their applicability in solving real-life problems. In this paper, we introduce a novel, versatile framework for causal discovery that accommodates the presence of causally-related hidden variables almost everywhere in the causal network (for instance, they can be effects of observed variables), based on rank information of covariance matrix over observed variables. We start by investigating the efficacy of rank in comparison to conditional independence and, theoretically, establish necessary and sufficient conditions for the identifiability of certain latent structural patterns. Furthermore, we develop a Rank-based Latent Causal Discovery algorithm, RLCD, that can efficiently locate hidden variables, determine their cardinalities, and discover the entire causal structure over both measured and hidden ones. We also show that, under certain graphical conditions, RLCD correctly identifies the Markov Equivalence Class of the whole latent causal graph asymptotically. Experimental results on both synthetic and real-world personality data sets demonstrate the efficacy of the proposed approach in finite-sample cases.




Abstract:In machine learning, generalization against distribution shifts -- where deployment conditions diverge from the training scenarios -- is crucial, particularly in fields like climate modeling, biomedicine, and autonomous driving. The emergence of foundation models, distinguished by their extensive pretraining and task versatility, has led to an increased interest in their adaptability to distribution shifts. GPT-4V(ision) acts as the most advanced publicly accessible multimodal foundation model, with extensive applications across various domains, including anomaly detection, video understanding, image generation, and medical diagnosis. However, its robustness against data distributions remains largely underexplored. Addressing this gap, this study rigorously evaluates GPT-4V's adaptability and generalization capabilities in dynamic environments, benchmarking against prominent models like CLIP and LLaVA. We delve into GPT-4V's zero-shot generalization across 13 diverse datasets spanning natural, medical, and molecular domains. We further investigate its adaptability to controlled data perturbations and examine the efficacy of in-context learning as a tool to enhance its adaptation. Our findings delineate GPT-4V's capability boundaries in distribution shifts, shedding light on its strengths and limitations across various scenarios. Importantly, this investigation contributes to our understanding of how AI foundation models generalize to distribution shifts, offering pivotal insights into their adaptability and robustness. Code is publicly available at https://github.com/jameszhou-gl/gpt-4v-distribution-shift.




Abstract:This study introduces Text-Guided Subject-Driven Image Inpainting, a novel task that combines text and exemplar images for image inpainting. While both text and exemplar images have been used independently in previous efforts, their combined utilization remains unexplored. Simultaneously accommodating both conditions poses a significant challenge due to the inherent balance required between editability and subject fidelity. To tackle this challenge, we propose a two-step approach DreamInpainter. First, we compute dense subject features to ensure accurate subject replication. Then, we employ a discriminative token selection module to eliminate redundant subject details, preserving the subject's identity while allowing changes according to other conditions such as mask shape and text prompts. Additionally, we introduce a decoupling regularization technique to enhance text control in the presence of exemplar images. Our extensive experiments demonstrate the superior performance of our method in terms of visual quality, identity preservation, and text control, showcasing its effectiveness in the context of text-guided subject-driven image inpainting.
Abstract:Although graph neural networks have achieved great success in the task of molecular property prediction in recent years, their generalization ability under out-of-distribution (OOD) settings is still under-explored. Different from existing methods that learn discriminative representations for prediction, we propose a generative model with semantic-components identifiability, named SCI. We demonstrate that the latent variables in this generative model can be explicitly identified into semantic-relevant (SR) and semantic-irrelevant (SI) components, which contributes to better OOD generalization by involving minimal change properties of causal mechanisms. Specifically, we first formulate the data generation process from the atom level to the molecular level, where the latent space is split into SI substructures, SR substructures, and SR atom variables. Sequentially, to reduce misidentification, we restrict the minimal changes of the SR atom variables and add a semantic latent substructure regularization to mitigate the variance of the SR substructure under augmented domain changes. Under mild assumptions, we prove the block-wise identifiability of the SR substructure and the comment-wise identifiability of SR atom variables. Experimental studies achieve state-of-the-art performance and show general improvement on 21 datasets in 3 mainstream benchmarks. Moreover, the visualization results of the proposed SCI method provide insightful case studies and explanations for the prediction results. The code is available at: https://github.com/DMIRLAB-Group/SCI.




Abstract:In this paper, we present the results of the NeurIPS-2022 Neural MMO Challenge, which attracted 500 participants and received over 1,600 submissions. Like the previous IJCAI-2022 Neural MMO Challenge, it involved agents from 16 populations surviving in procedurally generated worlds by collecting resources and defeating opponents. This year's competition runs on the latest v1.6 Neural MMO, which introduces new equipment, combat, trading, and a better scoring system. These elements combine to pose additional robustness and generalization challenges not present in previous competitions. This paper summarizes the design and results of the challenge, explores the potential of this environment as a benchmark for learning methods, and presents some practical reinforcement learning training approaches for complex tasks with sparse rewards. Additionally, we have open-sourced our baselines, including environment wrappers, benchmarks, and visualization tools for future research.