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6ebb92aad3a4fe7aae230b0e63c2ef35-Paper-Conference.pdf

Neural Information Processing Systems

Recent advances in multimodal models have raised questions about whether visionand-language models (VLMs) integrate cross-modal information in ways that reflect human cognition. One well-studied test case in this domain is the boubakiki effect, where humans reliably associate pseudowords like'bouba' with round shapes and'kiki' with jagged ones. Given the mixed evidence found in prior studies for this effect in VLMs, we present a comprehensive re-evaluation focused on two variants of CLIP, ResNet and Vision Transformer (ViT), given their centrality in many state-of-the-art VLMs. We apply two complementary methods closely modelled after human experiments: a prompt-based evaluation that uses probabilities as a measure of model preference, and we use Grad-CAM as a novel approach to interpret visual attention in shape-word matching tasks. Our findings show that these model variants do not consistently exhibit the bouba-kiki effect. While ResNet shows a preference for round shapes, overall performance across both model variants lacks the expected associations. Moreover, direct comparison with prior human data on the same task shows that the models' responses fall markedly short of the robust, modality-integrated behaviour characteristic of human cognition. These results contribute to the ongoing debate about the extent to which VLMs truly understand cross-modal concepts, highlighting limitations in their internal representations and alignment with human intuitions.


Backpropagation-Free Test-Time Adaptation via Probabilistic Gaussian Alignment

Neural Information Processing Systems

Test-time adaptation (TTA) enhances the zero-shot robustness under distribution shifts by leveraging unlabeled test data during inference. Despite notable advances, several challenges still limit its broader applicability. First, most methods rely on backpropagation or iterative optimization, which limits scalability and hinders real-time deployment. Second, they lack explicit modeling of class-conditional feature distributions. This modeling is crucial for producing reliable decision boundaries and calibrated predictions, but it remains underexplored due to the lack of both source data and supervision at test time.


Dynamic Diffusion Schrรถdinger Bridge in Astrophysical Observational Inversions

Neural Information Processing Systems

We study Diffusion Schrรถdinger Bridge (DSB) models in the context of dynamical astrophysical systems, specifically tackling observational inverse prediction tasks within Giant Molecular Clouds (GMCs) for star formation. We introduce the AstroDSB model, a variant of DSB with the pairwise domain assumption tailored for astrophysical dynamics.


Hierarchical Implicit Neural Emulators

Neural Information Processing Systems

Neural PDE solvers offer a powerful tool for modeling complex dynamical systems, but often struggle with error accumulation over long time horizons and maintaining stability and physical consistency. We introduce a multiscale implicit neural emulator that enhances long-term prediction accuracy by conditioning on a hierarchy of lower-dimensional future state representations. Inspired by the stability properties of numerical implicit time-stepping methods, we developed an approach that leverages predictions several steps ahead in time at increasing compression rates for next-timestep refinements. By actively adjusting the temporal downsampling ratios, our design enables the model to capture dynamics across multiple granularities and enforce long-range temporal coherence. Experiments on turbulent fluid dynamics show that our method achieves high short-term accuracy and produces long-term stable forecasts, significantly outperforming non-hierarchical autoregressive baselines while adding minimal computational overhead. The codebase is available at this link1.


Quantifying Distributional Invariance in Causal Subgraph for IRM-Free Graph Generalization

Neural Information Processing Systems

Out-of-distribution generalization under distributional shifts remains a critical challenge for graph neural networks. Existing methods generally adopt the Invariant Risk Minimization (IRM) framework, requiring costly environment annotations or heuristically generated synthetic splits. To circumvent these limitations, in this work, we aim to develop an IRM-free method for capturing causal subgraphs. We first identify that causal subgraphs exhibit substantially smaller distributional variations than non-causal components across diverse environments, which we formalize as the Invariant Distribution Criterion and theoretically prove in this paper. Building on this criterion, we systematically uncover the quantitative relationship between distributional shift and representation norm for identifying the causal subgraph, and investigate its underlying mechanisms in depth. Finally, we propose an IRM-free method by introducing a norm-guided invariant distribution objective for causal subgraph discovery and prediction. Extensive experiments on two widely used benchmarks demonstrate that our method consistently outperforms state-of-the-art methods in graph generalization. Code is available at https: //github.com/anders1123/IDG.


Frรฉchet Geodesic Boosting

Neural Information Processing Systems

Gradient boosting has become a cornerstone of machine learning, enabling base learners such as decision trees to achieve exceptional predictive performance. While existing algorithms primarily handle scalar or Euclidean outputs, increasingly prevalent complex-structured data, such as distributions, networks, and manifoldvalued outputs, present challenges for traditional methods. Such non-Euclidean data lack algebraic structures such as addition, subtraction, or scalar multiplication required by standard gradient boosting frameworks. To address these challenges, we introduce Frรฉchet geodesic boosting (FGBoost), a novel approach tailored for outputs residing in geodesic metric spaces. FGBoost leverages geodesics as proxies for residuals and constructs ensembles in a way that respects the intrinsic geometry of the output space. Through theoretical analysis, extensive simulations, and realworld applications, we demonstrate the strong performance and adaptability of FGBoost, showcasing its potential for modeling complex data.


Probabilistic Stability Guarantees for Feature Attributions

Neural Information Processing Systems

Stability guarantees have emerged as a principled way to evaluate feature attributions, but existing certification methods rely on heavily smoothed classifiers and often produce conservative guarantees. To address these limitations, we introduce soft stability and propose a simple, model-agnostic, sample-efficient stability certification algorithm (SCA) that yields non-trivial and interpretable guarantees for any attribution method. Moreover, we show that mild smoothing achieves a more favorable trade-off between accuracy and stability, avoiding the aggressive compromises made in prior certification methods. To explain this behavior, we use Boolean function analysis to derive a novel characterization of stability under smoothing. We evaluate SCA on vision and language tasks and demonstrate the effectiveness of soft stability in measuring the robustness of explanation methods.


CLIPTTA: Robust Contrastive Vision-Language Test-Time Adaptation

Neural Information Processing Systems

Vision-language models (VLMs) like CLIP exhibit strong zero-shot capabilities but often fail to generalize under distribution shifts. Test-time adaptation (TTA) allows models to update at inference time without labeled data, typically via entropy minimization. However, this objective is fundamentally misaligned with the contrastive image-text training of VLMs, limiting adaptation performance and introducing failure modes such as pseudo-label drift and class collapse. We propose CLIPTTA, a new gradient-based TTA method for vision-language models that leverages a soft contrastive loss aligned with CLIP's pre-training objective. We provide a theoretical analysis of CLIPTTA's gradients, showing how its batchaware design mitigates the risk of collapse. We further extend CLIPTTA to the open-set setting, where both in-distribution (ID) and out-of-distribution (OOD) samples are encountered, using an Outlier Contrastive Exposure (OCE) loss to improve OOD detection. Evaluated on 75 datasets spanning diverse distribution shifts, CLIPTTA consistently outperforms entropy-based objectives and is highly competitive with state-of-the-art TTA methods, outperforming them on a large number of datasets and exhibiting more stable performance across diverse shifts. Source code is available at: CLIPTTARepository.


DiCoFlex: Model-agnostic diverse counterfactuals with flexible control

Neural Information Processing Systems

Counterfactual explanations play a pivotal role in explainable artificial intelligence (XAI) by offering intuitive, human-understandable alternatives that elucidate machine learning model decisions. Despite their significance, existing methods for generating counterfactuals often require constant access to the predictive model, involve computationally intensive optimization for each instance and lack the flexibility to adapt to new user-defined constraints without retraining. In this paper, we propose DiCoFlex, a novel model-agnostic, conditional generative framework that produces multiple diverse counterfactuals in a single forward pass. Leveraging conditional normalizing flows trained solely on labeled data, DiCoFlex addresses key limitations by enabling real-time user-driven customization of constraints such as sparsity and actionability at inference time. Extensive experiments on standard benchmark datasets show that DiCoFlex outperforms existing methods in terms of validity, diversity, proximity, and constraint adherence, making it a practical and scalable solution for counterfactual generation in sensitive decision-making domains.


Conformal Risk Training: End-to-End Optimization of Conformal Risk Control

Neural Information Processing Systems

While deep learning models often achieve high predictive accuracy, their predictions typically do not come with any provable guarantees on risk or reliability, which are critical for deployment in high-stakes applications. The framework of conformal risk control (CRC) provides a distribution-free, finite-sample method for controlling the expected value of any bounded monotone loss function and can be conveniently applied post-hoc to any pre-trained deep learning model. However, many realworld applications are sensitive to tail risks, as opposed to just expected loss. In this work, we develop a method for controlling the general class of Optimized CertaintyEquivalent (OCE) risks, a broad class of risk measures which includes as special cases the expected loss (generalizing the original CRC method) and common tail risks like the conditional value-at-risk (CVaR).