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Approximation-Aware Bayesian Optimization

Neural Information Processing Systems

High-dimensional Bayesian optimization (BO) tasks such as molecular design often require $> 10,$$000$ function evaluations before obtaining meaningful results. While methods like sparse variational Gaussian processes (SVGPs) reduce computational requirements in these settings, the underlying approximations result in suboptimal data acquisitions that slow the progress of optimization. In this paper we modify SVGPs to better align with the goals of BO: targeting informed data acquisition over global posterior fidelity. Using the framework of utility-calibrated variational inference (Lacoste-Julien et al., 2011), we unify GP approximation and data acquisition into a joint optimization problem, thereby ensuring optimal decisions under a limited computational budget. Our approach can be used with any decision-theoretic acquisition function and is readily compatible with trust region methods like TuRBO (Eriksson et al., 2019). We derive efficient joint objectives for the expected improvement (EI) and knowledge gradient (KG) acquisition functions in both the standard and batch BO settings. On a variety of recent high dimensional benchmark tasks in control and molecular design, our approach significantly outperforms standard SVGPs and is capable of achieving comparable rewards with up to $10\times$ fewer function evaluations.


Watermarking Makes Language Models Radioactive

Neural Information Processing Systems

We investigate the radioactivity of text generated by large language models (LLM), \ie whether it is possible to detect that such synthetic input was used to train a subsequent LLM.Current methods like membership inference or active IP protection either work only in settings where the suspected text is known or do not provide reliable statistical guarantees.We discover that, on the contrary, it is possible to reliably determine if a language model was trained on synthetic data if that data is output by a watermarked LLM.Our new methods, specialized for radioactivity, detects with a provable confidence weak residuals of the watermark signal in the fine-tuned LLM.We link the radioactivity contamination level to the following properties: the watermark robustness, its proportion in the training set, and the fine-tuning process.For instance, if the suspect model is open-weight, we demonstrate that training on watermarked instructions can be detected with high confidence ($p$-value $ < 10^{-5}$) even when as little as $5\%$ of training text is watermarked.


Bridging semantics and pragmatics in information-theoretic emergent communication

Neural Information Processing Systems

Human languages support both semantic categorization and local pragmatic interactions that require context-sensitive reasoning about meaning. While semantics and pragmatics are two fundamental aspects of language, they are typically studied independently and their co-evolution is largely under-explored. Here, we aim to bridge this gap by studying how a shared lexicon may emerge from local pragmatic interactions. To this end, we extend a recent information-theoretic framework for emergent communication in artificial agents, which integrates utility maximization, associated with pragmatics, with general communicative constraints that are believed to shape human semantic systems. Specifically, we show how to adapt this framework to train agents via unsupervised pragmatic interactions, and then evaluate their emergent lexical semantics. We test this approach in a rich visual domain of naturalistic images, and find that key human-like properties of the lexicon emerge when agents are guided by both context-specific utility and general communicative pressures, suggesting that both aspects are crucial for understanding how language may evolve in humans and in artificial agents.


A Unified Debiasing Approach for Vision-Language Models across Modalities and Tasks

Neural Information Processing Systems

Recent advancements in Vision-Language Models (VLMs) have enabled complex multimodal tasks by processing text and image data simultaneously, significantly enhancing the field of artificial intelligence.


Mystery AI model suspected to be DeepSeek V4 is revealed to be from Xiaomi

The Japan Times

A powerful artificial intelligence model that appeared anonymously on a developer platform last week was revealed to be from Chinese smartphone and electric vehicle giant Xiaomi, and not DeepSeek as initially thought. BEIJING - A powerful artificial intelligence model that appeared anonymously on a developer platform last week was revealed on Wednesday to be from Chinese smartphone and electric vehicle giant Xiaomi, after it fueled speculation that startup DeepSeek was quietly testing its next-generation system ahead of a launch. The release of DeepSeek's low-cost models DeepSeek-V3 and R1 triggered a global tech stock selloff last year, causing investors to question whether U.S. AI firms needed to spend billions of dollars on AI computing power. Since then, there has been a great deal of interest in DeepSeek-V4, a next-generation model that has yet to be released. The mysterious free model, called Hunter Alpha, surfaced on the AI gateway platform OpenRouter on March 11 without any developer attribution and was later described by the platform as a "stealth model." In a time of both misinformation and too much information, quality journalism is more crucial than ever.


Scalable Sensitivity and Uncertainty Analyses for Causal-Effect Estimates of Continuous-Valued Interventions

Neural Information Processing Systems

Estimating the effects of continuous-valued interventions from observational data is a critically important task for climate science, healthcare, and economics. Recent work focuses on designing neural network architectures and regularization functions to allow for scalable estimation of average and individual-level dose-response curves from high-dimensional, large-sample data. Such methodologies assume ignorability (observation of all confounding variables) and positivity (observation of all treatment levels for every covariate value describing a set of units), assumptions problematic in the continuous treatment regime. Scalable sensitivity and uncertainty analyses to understand the ignorance induced in causal estimates when these assumptions are relaxed are less studied. Here, we develop a continuous treatment-effect marginal sensitivity model (CMSM) and derive bounds that agree with the observed data and a researcher-defined level of hidden confounding. We introduce a scalable algorithm and uncertainty-aware deep models to derive and estimate these bounds for high-dimensional, large-sample observational data. We work in concert with climate scientists interested in the climatological impacts of human emissions on cloud properties using satellite observations from the past 15 years. This problem is known to be complicated by many unobserved confounders.


Derivative-enhanced Deep Operator Network

Neural Information Processing Systems

The deep operator networks (DeepONet), a class of neural operators that learn mappings between function spaces, have recently been developed as surrogate models for parametric partial differential equations (PDEs). In this work we propose a derivative-enhanced deep operator network (DE-DeepONet), which leverages derivative information to enhance the solution prediction accuracy and provides a more accurate approximation of solution-to-parameter derivatives, especially when training data are limited. DE-DeepONet explicitly incorporates linear dimension reduction of high dimensional parameter input into DeepONet to reduce training cost and adds derivative loss in the loss function to reduce the number of required parameter-solution pairs. We further demonstrate that the use of derivative loss can be extended to enhance other neural operators, such as the Fourier neural operator (FNO).


Maia-2: A Unified Model for Human-AI Alignment in Chess

Neural Information Processing Systems

There are an increasing number of domains in which artificial intelligence (AI) systems both surpass human ability and accurately model human behavior. This introduces the possibility of algorithmically-informed teaching in these domains through more relatable AI partners and deeper insights into human decision-making. Critical to achieving this goal, however, is coherently modeling human behavior at various skill levels. Chess is an ideal model system for conducting research into this kind of human-AI alignment, with its rich history as a pivotal testbed for AI research, mature superhuman AI systems like AlphaZero, and precise measurements of skill via chess rating systems. Previous work in modeling human decision-making in chess uses completely independent models to capture human style at different skill levels, meaning they lack coherence in their ability to adapt to the full spectrum of human improvement and are ultimately limited in their effectiveness as AI partners and teaching tools. In this work, we propose a unified modeling approach for human-AI alignment in chess that coherently captures human style across different skill levels and directly captures how people improve. Recognizing the complex, non-linear nature of human learning, we introduce a skill-aware attention mechanism to dynamically integrate players' strengths with encoded chess positions, enabling our model to be sensitive to evolving player skill. Our experimental results demonstrate that this unified framework significantly enhances the alignment between AI and human players across a diverse range of expertise levels, paving the way for deeper insights into human decision-making and AI-guided teaching tools.


Boosting the Transferability of Adversarial Attack on Vision Transformer with Adaptive Token Tuning

Neural Information Processing Systems

Vision transformers (ViTs) perform exceptionally well in various computer vision tasks but remain vulnerable to adversarial attacks. Recent studies have shown that the transferability of adversarial examples exists for CNNs, and the same holds true for ViTs. However, existing ViT attacks aggressively regularize the largest token gradients to exact zero within each layer of the surrogate model, overlooking the interactions between layers, which limits their transferability in attacking black-box models. Therefore, in this paper, we focus on boosting the transferability of adversarial attacks on ViTs through adaptive token tuning (ATT). Specifically, we propose three optimization strategies: an adaptive gradient re-scaling strategy to reduce the overall variance of token gradients, a self-paced patch out strategy to enhance the diversity of input tokens, and a hybrid token gradient truncation strategy to weaken the effectiveness of attention mechanism.


Local Superior Soups: A Catalyst for Model Merging in Cross-Silo Federated Learning

Neural Information Processing Systems

Federated learning (FL) is a learning paradigm that enables collaborative training of models using decentralized data. Recently, the utilization of pre-trained weight initialization in FL has been demonstrated to effectively improve model performance. However, the evolving complexity of current pre-trained models, characterized by a substantial increase in parameters, markedly intensifies the challenges associated with communication rounds required for their adaptation to FL. To address these communication cost issues and increase the performance of pre-trained model adaptation in FL, we propose an innovative model interpolation-based local training technique called ``Local Superior Soups.''Our