MLAug 18, 2024
Efficient Budget Allocation for Large-Scale LLM-Enabled Virtual ScreeningZaile Li, Weiwei Fan, L. Jeff Hong
Screening tasks that aim to identify a small subset of top alternatives from a large pool are common in business decision-making processes. These tasks often require substantial human effort to evaluate each alternative's performance, making them time-consuming and costly. Motivated by recent advances in large language models (LLMs), particularly their ability to generate outputs that align well with human evaluations, we consider an LLM-as-human-evaluator approach for conducting screening virtually, thereby reducing the cost burden. To achieve scalability and cost-effectiveness in virtual screening, we identify that the stochastic nature of LLM outputs and their cost structure necessitate efficient budget allocation across all alternatives. To address this, we propose using a top-$m$ greedy evaluation mechanism, a simple yet effective approach that keeps evaluating the current top-$m$ alternatives, and design the explore-first top-$m$ greedy (EFG-$m$) algorithm. We prove that EFG-$m$ is both sample-optimal and consistent in large-scale virtual screening. Surprisingly, we also uncover a bonus ranking effect, where the algorithm naturally induces an indifference-based ranking within the selected subset. To further enhance practicality, we design a suite of algorithm variants to improve screening performance and computational efficiency. Numerical experiments validate our results and demonstrate the effectiveness of our algorithms. Lastly, we conduct a case study on LLM-based virtual screening. The study shows that while LLMs alone may not provide meaningful screening and ranking results when directly queried, integrating them with our sample-optimal algorithms unlocks their potential for cost-effective, large-scale virtual screening.
MLNov 27, 2025
UCB for Large-Scale Pure Exploration: Beyond Sub-GaussianityZaile Li, Weiwei Fan, L. Jeff Hong
Selecting the best alternative from a finite set represents a broad class of pure exploration problems. Traditional approaches to pure exploration have predominantly relied on Gaussian or sub-Gaussian assumptions on the performance distributions of all alternatives, which limit their applicability to non-sub-Gaussian especially heavy-tailed problems. The need to move beyond sub-Gaussianity may become even more critical in large-scale problems, which tend to be especially sensitive to distributional specifications. In this paper, motivated by the widespread use of upper confidence bound (UCB) algorithms in pure exploration and beyond, we investigate their performance in the large-scale, non-sub-Gaussian settings. We consider the simplest category of UCB algorithms, where the UCB value for each alternative is defined as the sample mean plus an exploration bonus that depends only on its own sample size. We abstract this into a meta-UCB algorithm and propose letting it select the alternative with the largest sample size as the best upon stopping. For this meta-UCB algorithm, we first derive a distribution-free lower bound on the probability of correct selection. Building on this bound, we analyze two general non-sub-Gaussian scenarios: (1) all alternatives follow a common location-scale structure and have bounded variance; and (2) when such a structure does not hold, each alternative has a bounded absolute moment of order $q > 3$. In both settings, we show that the meta-UCB algorithm and therefore a broad class of UCB algorithms can achieve the sample optimality. These results demonstrate the applicability of UCB algorithms for solving large-scale pure exploration problems with non-sub-Gaussian distributions. Numerical experiments support our results and provide additional insights into the comparative behaviors of UCB algorithms within and beyond our meta-UCB framework.
LGJan 29, 2024
A Deep Q-Network Based on Radial Basis Functions for Multi-Echelon Inventory ManagementLiqiang Cheng, Jun Luo, Weiwei Fan et al.
This paper addresses a multi-echelon inventory management problem with a complex network topology where deriving optimal ordering decisions is difficult. Deep reinforcement learning (DRL) has recently shown potential in solving such problems, while designing the neural networks in DRL remains a challenge. In order to address this, a DRL model is developed whose Q-network is based on radial basis functions. The approach can be more easily constructed compared to classic DRL models based on neural networks, thus alleviating the computational burden of hyperparameter tuning. Through a series of simulation experiments, the superior performance of this approach is demonstrated compared to the simple base-stock policy, producing a better policy in the multi-echelon system and competitive performance in the serial system where the base-stock policy is optimal. In addition, the approach outperforms current DRL approaches.