Jana Doppa

Subhankar Ghosh, Yuanjie Shi, Taha Belkhouja et al.

Conformal prediction (CP) is a framework to quantify uncertainty of machine learning classifiers including deep neural networks. Given a testing example and a trained classifier, CP produces a prediction set of candidate labels with a user-specified coverage (i.e., true class label is contained with high probability). Almost all the existing work on CP assumes clean testing data and there is not much known about the robustness of CP algorithms w.r.t natural/adversarial perturbations to testing examples. This paper studies the problem of probabilistically robust conformal prediction (PRCP) which ensures robustness to most perturbations around clean input examples. PRCP generalizes the standard CP (cannot handle perturbations) and adversarially robust CP (ensures robustness w.r.t worst-case perturbations) to achieve better trade-offs between nominal performance and robustness. We propose a novel adaptive PRCP (aPRCP) algorithm to achieve probabilistically robust coverage. The key idea behind aPRCP is to determine two parallel thresholds, one for data samples and another one for the perturbations on data (aka "quantile-of-quantile" design). We provide theoretical analysis to show that aPRCP algorithm achieves robust coverage. Our experiments on CIFAR-10, CIFAR-100, and ImageNet datasets using deep neural networks demonstrate that aPRCP achieves better trade-offs than state-of-the-art CP and adversarially robust CP algorithms.

Long Minh Bui, Tuan Anh Le Van, Tung Phi Duc et al.

Model merging aims to combine existing single-task solutions into a multi-task solution without additional data-driven fine-tuning.~Most existing approaches achieve this using geometric properties of local solution spaces. However, such geometric views provide limited guidance for scoring how statistically useful each task-specific update direction is across tasks during merging. To address this, we formulate model merging from a new perspective of probabilistic inference under a product-of-experts (PoE) scenario where each single-task solution defines an energy-based expert model (EBM) over the merged parameters. We show that several existing model merging methods arise as special cases of our framework under energy designs that impose implicit Gaussian assumptions on directional residuals between merged and task-specific models. Empirically, we find that these residuals are often heavy-tailed which exposes a mismatch with the imposed light-tailed Gaussian structures. We address this with a heavy-tailed PoE design based on Cauchy experts, which better captures the observed residual behavior while admitting a provably convergent inference procedure. Experiments across multiple tasks and architectures show significant improvements over state-of-the-arts baselines. Our code is available at https://github.com/MinhLong210/PoE-EBM-Merging.git.

Azza Fadhel, The Hung Tran, Trong Nghia Hoang et al.

We consider the problem of offline black-box optimization, where the goal is to discover optimal designs (e.g., molecules or materials) from past experimental data. A key challenge in this setting is data scarcity: in many scientific applications, only small or poor-quality datasets are available, which severely limits the effectiveness of existing algorithms. Prior work has theoretically and empirically shown that performance of offline optimization algorithms depends on how well the surrogate model captures the optimization bias (i.e., ability to rank input designs correctly), which is challenging to accomplish with limited experimental data. This paper proposes Surrogate Learning with Optimization Bias via Synthetic Task Generation (OptBias), a meta-learning framework that directly tackles data scarcity. OptBias learns a reusable optimization bias by training on synthetic tasks generated from a Gaussian process, and then fine-tunes the surrogate model on the small data for the target task. Across diverse continuous and discrete offline optimization benchmarks, OptBias consistently outperforms state-of-the-art baselines in small data regimes. These results highlight OptBias as a robust and practical solution for offline optimization in realistic small data settings.