Paula Rodriguez-Diaz

Paula Rodriguez-Diaz, Lingkai Kong, Kai Wang et al. · harvard, microsoft-research

Comparing datasets is a fundamental task in machine learning, essential for various learning paradigms-from evaluating train and test datasets for model generalization to using dataset similarity for detecting data drift. While traditional notions of dataset distances offer principled measures of similarity, their utility has largely been assessed through prediction error minimization. However, in Predict-then-Optimize (PtO) frameworks, where predictions serve as inputs for downstream optimization tasks, model performance is measured through decision regret rather than prediction error. In this work, we propose OTD$^3$ (Optimal Transport Decision-aware Dataset Distance), a novel dataset distance that incorporates downstream decisions in addition to features and labels. We show that traditional feature-label distances lack informativeness in PtO settings, while OTD$^3$ more effectively captures adaptation success. We also derive a PtO-specific adaptation bound based on this distance. Empirically, we show that our proposed distance accurately predicts model transferability across three different PtO tasks from the literature. The code is available at https://github.com/paularodr/OTD3.

Nihal V. Nayak, Paula Rodriguez-Diaz, Neha Hulkund et al. · harvard, microsoft-research

Instruction fine-tuning of large language models (LLMs) often involves selecting a subset of instruction training data from a large candidate pool, using a small query set from the target task. Despite growing interest, the literature on targeted instruction selection remains fragmented and opaque: methods vary widely in selection budgets, often omit zero-shot baselines, and frequently entangle the contributions of key components. As a result, practitioners lack actionable guidance on selecting instructions for their target tasks. In this work, we aim to bring clarity to this landscape by disentangling and systematically analyzing the two core ingredients: data representation and selection algorithms. Our framework enables controlled comparisons across models, tasks, and budgets. We find that only gradient-based data representations choose subsets whose similarity to the query consistently predicts performance across datasets and models. While no single method dominates, gradient-based representations paired with a greedy round-robin selection algorithm tend to perform best on average at low budgets, but these benefits diminish at larger budgets. Finally, we unify several existing selection algorithms as forms of approximate distance minimization between the selected subset and the query set, and support this view with new generalization bounds. More broadly, our findings provide critical insights and a foundation for more principled data selection in LLM fine-tuning. The code is available at https://github.com/dcml-lab/targeted-instruction-selection.

Arya Tschand, Chenyu Wang, Zishen Wan et al. · harvard

Generative AI is reshaping how computing systems are designed, optimized, and built, yet research remains fragmented across software, architecture, and chip design communities. This paper takes a cross-stack perspective, examining how generative models are being applied from code generation and distributed runtimes through hardware design space exploration to RTL synthesis, physical layout, and verification. Rather than reviewing each layer in isolation, we analyze how the same structural difficulties and effective responses recur across the stack. Our central finding is one of convergence. Despite the diversity of domains and tools, the field keeps encountering five recurring challenges (the feedback loop crisis, the tacit knowledge problem, trust and validation, co-design across boundaries, and the shift from determinism to dynamism) and keeps arriving at five design principles that independently emerge as effective responses (embracing hybrid approaches, designing for continuous feedback, separating concerns by role, matching methods to problem structure, and building on decades of systems knowledge). We organize these into a challenge--principle map that serves as a diagnostic and design aid, showing which principles have proven effective for which challenges across layers. Through concrete cross-stack examples, we show how systems navigate this map as they mature, and argue that the field needs shared engineering methodology, including common vocabularies, cross-layer benchmarks, and systematic design practices, so that progress compounds across communities rather than being rediscovered in each one. Our analysis covers more than 275 papers spanning eleven application areas across three layers of the computing stack, and distills open research questions that become visible only from a cross-layer vantage point.

Paula Rodriguez-Diaz, Kirk Bansak Elisabeth Paulson

Many real-world decisions are made under uncertainty by solving optimization problems using predicted quantities. This predict-then-optimize paradigm has motivated decision-focused learning, which trains models with awareness of how the optimizer uses predictions, improving the performance of downstream decisions. Despite its promise, scaling is challenging: state-of-the-art methods either differentiate through a solver or rely on task-specific surrogates, both of which require frequent and expensive calls to an optimizer, often a combinatorial one. In this paper, we leverage dual variables from the downstream problem to shape learning and introduce Dual-Guided Loss (DGL), a simple, scalable objective that preserves decision alignment while reducing solver dependence. We construct DGL specifically for combinatorial selection problems with natural one-of-many constraints, such as matching, knapsack, and shortest path. Our approach (a) decouples optimization from gradient updates by solving the downstream problem only periodically; (b) between refreshes, trains on dual-adjusted targets using simple differentiable surrogate losses; and (c) as refreshes become less frequent, drives training cost toward standard supervised learning while retaining strong decision alignment. We prove that DGL has asymptotically diminishing decision regret, analyze runtime complexity, and show on two problem classes that DGL matches or exceeds state-of-the-art DFL methods while using far fewer solver calls and substantially less training time. Code is available at https://github.com/paularodr/Dual-Guided-Learning.