MPI-IS
Abstract:With recent progress on fine-tuning language models around a fixed sparse autoencoder, we disentangle the decoder matrix into almost orthogonal features. This reduces interference and superposition between the features, while keeping performance on the target dataset essentially unchanged. Our orthogonality penalty leads to identifiable features, ensuring the uniqueness of the decomposition. Further, we find that the distance between embedded feature explanations increases with stricter orthogonality penalty, a desirable property for interpretability. Invoking the $\textit{Independent Causal Mechanisms}$ principle, we argue that orthogonality promotes modular representations amenable to causal intervention. We empirically show that these increasingly orthogonalized features allow for isolated interventions. Our code is available under $\texttt{https://github.com/mrtzmllr/sae-icm}$.
Abstract:We introduce the (Wishart) projection mechanism, a randomized map of the form $S \mapsto M f(S)$ with $M \sim W_d(1/r I_d, r)$ and study its differential privacy properties. For vector-valued queries $f$, we prove non-asymptotic DP guarantees without any additive noise, showing that Wishart randomness alone can suffice. For matrix-valued queries, however, we establish a sharp negative result: in the noise-free setting, the mechanism is not DP, and we demonstrate its vulnerability by implementing a near perfect membership inference attack (AUC $> 0.99$). We then analyze a noisy variant and prove privacy amplification due to randomness and low rank projection, in both large- and small-rank regimes, yielding stronger privacy guarantees than additive noise alone. Finally, we show that LoRA-style updates are an instance of the matrix-valued mechanism, implying that LoRA is not inherently private despite its built-in randomness, but that low-rank fine-tuning can be more private than full fine-tuning at the same noise level. Preliminary experiments suggest that tighter accounting enables lower noise and improved accuracy in practice.
Abstract:Learning structural information from observational data is central to producing new knowledge outside the training corpus. This holds for mechanistic understanding in scientific discovery as well as flexible test-time compositional generation. We thus study how language models learn abstract structures and utilize the learnt structural information at test-time. To ensure a controlled setup, we design a natural language dataset based on linguistic structural transformations. We empirically show that the emergence of learning structural information correlates with complex reasoning tasks, and that the ability to perform test-time compositional generation remains limited.
Abstract:Perturbation screens hold the potential to systematically map regulatory processes at single-cell resolution, yet modeling and predicting transcriptome-wide responses to perturbations remains a major computational challenge. Existing methods often underperform simple baselines, fail to disentangle measurement noise from biological signal, and provide limited insight into the causal structure governing cellular responses. Here, we present the latent causal diffusion (LCD), a generative model that frames single-cell gene expression as a stationary diffusion process observed under measurement noise. LCD outperforms established approaches in predicting the distributional shifts of unseen perturbation combinations in single-cell RNA-sequencing screens while simultaneously learning a mechanistic dynamical system of gene regulation. To interpret these learned dynamics, we develop an approach we call causal linearization via perturbation responses (CLIPR), which yields an approximation of the direct causal effects between all genes modeled by the diffusion. CLIPR provably identifies causal effects under a linear drift assumption and recovers causal structure in both simulated systems and a genome-wide perturbation screen, where it clusters genes into coherent functional modules and resolves causal relationships that standard differential expression analysis cannot. The LCD-CLIPR framework bridges generative modeling with causal inference to predict unseen perturbation effects and map the underlying regulatory mechanisms of the transcriptome.




Abstract:It has been hypothesized that human-level visual perception requires a generative approach in which internal representations result from inverting a decoder. Yet today's most successful vision models are non-generative, relying on an encoder that maps images to representations without decoder inversion. This raises the question of whether generation is, in fact, necessary for machines to achieve human-level visual perception. To address this, we study whether generative and non-generative methods can achieve compositional generalization, a hallmark of human perception. Under a compositional data generating process, we formalize the inductive biases required to guarantee compositional generalization in decoder-based (generative) and encoder-based (non-generative) methods. We then show theoretically that enforcing these inductive biases on encoders is generally infeasible using regularization or architectural constraints. In contrast, for generative methods, the inductive biases can be enforced straightforwardly, thereby enabling compositional generalization by constraining a decoder and inverting it. We highlight how this inversion can be performed efficiently, either online through gradient-based search or offline through generative replay. We examine the empirical implications of our theory by training a range of generative and non-generative methods on photorealistic image datasets. We find that, without the necessary inductive biases, non-generative methods often fail to generalize compositionally and require large-scale pretraining or added supervision to improve generalization. By comparison, generative methods yield significant improvements in compositional generalization, without requiring additional data, by leveraging suitable inductive biases on a decoder along with search and replay.




Abstract:Modern LLM pre-training consumes vast amounts of compute and training data, making the scaling behavior, or scaling laws, of different models a key distinguishing factor. Discrete diffusion language models (DLMs) have been proposed as an alternative to autoregressive language models (ALMs). However, their scaling behavior has not yet been fully explored, with prior work suggesting that they require more data and compute to match the performance of ALMs. We study the scaling behavior of DLMs on different noise types by smoothly interpolating between masked and uniform diffusion while paying close attention to crucial hyperparameters such as batch size and learning rate. Our experiments reveal that the scaling behavior of DLMs strongly depends on the noise type and is considerably different from ALMs. While all noise types converge to similar loss values in compute-bound scaling, we find that uniform diffusion requires more parameters and less data for compute-efficient training compared to masked diffusion, making them a promising candidate in data-bound settings. We scale our uniform diffusion model up to 10B parameters trained for $10^{22}$ FLOPs, confirming the predicted scaling behavior and making it the largest publicly known uniform diffusion model to date.
Abstract:Machine learning (ML) is transforming healthcare, but safe clinical decisions demand reliable uncertainty estimates that standard ML models fail to provide. Conformal prediction (CP) is a popular tool that allows users to turn heuristic uncertainty estimates into uncertainty estimates with statistical guarantees. CP works by converting predictions of a ML model, together with a calibration sample, into prediction sets that are guaranteed to contain the true label with any desired probability. An often cited advantage is that CP theory holds for calibration samples of arbitrary size, suggesting that uncertainty estimates with practically meaningful statistical guarantees can be achieved even if only small calibration sets are available. We question this promise by showing that, although the statistical guarantees hold for calibration sets of arbitrary size, the practical utility of these guarantees does highly depend on the size of the calibration set. This observation is relevant in medical domains because data is often scarce and obtaining large calibration sets is therefore infeasible. We corroborate our critique in an empirical demonstration on a medical image classification task.




Abstract:Multilingual Large Language Models (LLMs) can process many languages, yet how they internally represent this diversity remains unclear. Do they form shared multilingual representations with language-specific decoding, and if so, why does performance still favor the dominant training language? To address this, we train a series of LLMs on different mixtures of multilingual data and analyze their internal mechanisms using cross-layer transcoders (CLT) and attribution graphs. Our results provide strong evidence for pivot language representations: the model employs nearly identical representations across languages, while language-specific decoding emerges in later layers. Attribution analyses reveal that decoding relies in part on a small set of high-frequency language features in the final layers, which linearly read out language identity from the first layers in the model. By intervening on these features, we can suppress one language and substitute another in the model's outputs. Finally, we study how the dominant training language influences these mechanisms across attribution graphs and decoding pathways. We argue that understanding this pivot-language mechanism is crucial for improving multilingual alignment in LLMs.




Abstract:The first tabular foundation model, TabPFN, and its successor TabPFNv2 have impacted tabular AI substantially, with dozens of methods building on it and hundreds of applications across different use cases. This report introduces TabPFN-2.5, the next generation of our tabular foundation model, built for datasets with up to 50,000 data points and 2,000 features, a 20x increase in data cells compared to TabPFNv2. TabPFN-2.5 is now the leading method for the industry standard benchmark TabArena (which contains datasets with up to 100,000 training data points), substantially outperforming tuned tree-based models and matching the accuracy of AutoGluon 1.4, a complex four-hour tuned ensemble that even includes the previous TabPFNv2. Remarkably, default TabPFN-2.5 has a 100% win rate against default XGBoost on small to medium-sized classification datasets (<=10,000 data points, 500 features) and a 87% win rate on larger datasets up to 100K samples and 2K features (85% for regression). For production use cases, we introduce a new distillation engine that converts TabPFN-2.5 into a compact MLP or tree ensemble, preserving most of its accuracy while delivering orders-of-magnitude lower latency and plug-and-play deployment. This new release will immediately strengthen the performance of the many applications and methods already built on the TabPFN ecosystem.
Abstract:AdaBoost sequentially fits so-called weak learners to minimize an exponential loss, which penalizes mislabeled data points more severely than other loss functions like cross-entropy. Paradoxically, AdaBoost generalizes well in practice as the number of weak learners grows. In the present work, we introduce Penalized Exponential Loss (PENEX), a new formulation of the multi-class exponential loss that is theoretically grounded and, in contrast to the existing formulation, amenable to optimization via first-order methods. We demonstrate both empirically and theoretically that PENEX implicitly maximizes margins of data points. Also, we show that gradient increments on PENEX implicitly parameterize weak learners in the boosting framework. Across computer vision and language tasks, we show that PENEX exhibits a regularizing effect often better than established methods with similar computational cost. Our results highlight PENEX's potential as an AdaBoost-inspired alternative for effective training and fine-tuning of deep neural networks.