Efficiently selects top-m designs for various contexts using sequential sampling.
problem Optimizing selection of top-m designs across different contexts.
method Formulated as a stochastic dynamic programming problem, developed sequential sampling policy.
result Asymptotically optimal sampling ratios for efficient selection.
Two simulation-based methods improve optimal sampling design in systems biology.
problem Optimal selection of sampling points for accurate parameter estimation in dynamical systems.
method E-optimal-ranking (EOR) and LSTM neural network-based methods.
result Simulation studies show the proposed methods outperform random selection and classical E-optimal design.
Optimizes survey design for private mean estimation with reduced variance.
problem Minimizing variance in private mean estimation with privacy constraints.
method Formulates optimal survey design as an optimization problem, determining optimal subsampling sizes to minimize variance.
result Identifies the first privacy-aware stratified sampling scheme that minimizes variance under different privacy mechanisms.
We study the optimal design problems where the goal is to choose a set of linear measurements to obtain the most accurate estimate of an unknown vector in d d d dimensions. We study the A A A -optimal design variant where the objective is to minimize the average variance of the error in the maximum likelihood estimate of th…
A new sampling strategy improves reliability and robustness optimization for complex designs.
problem High sample requirements for optimizing reliability and robustness in complex designs.
method Local Latin Hypercube Refinement (LoLHR) for multi-objective design uncertainty optimization.
result LoLHR achieves better results compared to other surrogate-based strategies.
Sampling one or more effective solutions from large search spaces is a recurring idea in machine learning, and sequential optimization has become a popular solution. Typical examples include data summarization, sample mining for predictive modeling and hyper-parameter optimization. Existing solutions attempt to adaptiv…
Neural Optimal Design of Experiments improves inverse problem solving efficiency.
problem Optimal experimental design in inverse problems.
method Jointly trains a reconstruction model and design variables in a single loop.
result Significantly reduces computational complexity and improves reconstruction accuracy.
LES optimizes designs by sampling descent sequences, achieving strong sample efficiency.
problem Optimizing large, complex design spaces is infeasible and unnecessary.
method LES uses Bayesian optimization to target solutions reachable by iterative optimizers.
result LES achieves strong sample efficiency compared to existing methods.
This paper analyzes OCBA algorithms' convergence rates for DEDS optimization.
problem Optimizing discrete-event dynamic systems with limited computing resources.
method Characterizes convergence rates of two OCBA algorithms under different performance measures.
result OCBA algorithms achieve optimal convergence rates under probability of correct selection and expected opportunity cost measures.
This paper proposes a new approach to construct high quality space-filling sample designs. First, we propose a novel technique to quantify the space-filling property and optimally trade-off uniformity and randomness in sample designs in arbitrary dimensions. Second, we connect the proposed metric (defined in the spatia…
Optimizes UUV hull design with a two-orders-of-magnitude speedup.
problem Designing efficient underwater vehicle hulls using CFD simulations.
method Bayesian Optimization-LCB algorithm and DNN-based surrogate model.
result Two-orders-of-magnitude speedup in design optimization process.
Algorithm identifies Pareto optimal designs efficiently for noisy, multi-objective functions.
problem Optimizing multi-objective functions with noisy data and large design spaces.
method Adaptive discretization and tree-based approach to identify Pareto optimal designs.
result Algorithm identifies Pareto optimal designs with fewer evaluations than exhaustive search.
Avare improves optimization and sampling with adaptive importance sampling.
problem Improving convergence rate of stochastic gradient-based algorithms.
method Adaptive importance sampling with decreasing step-sizes.
result Achieves dynamic regret bounds of O ( T 2 / 3 ) \mathcal{O}(T^{2/3}) O ( T 2/3 ) and O ( T 5 / 6 ) \mathcal{O}(T^{5/6}) O ( T 5/6 ) . New insights into how to inspect and learn from multi-stage processes and AI reasoning.
problem Understanding how to attribute outcomes to early stages in multi-stage operations and AI reasoning.
method Information-theoretic analysis and mathematical proofs of four key results.
result Uniform checkpoint spacing is minimax-optimal for inspection design under homogeneous signal attenuation.
TAD efficiently finds optimal settings for advanced manufacturing.
problem Optimizing high-dimensional process control parameters for optimal design features.
method TAD uses Gaussian process surrogate models and optimizes log-predictive likelihood to find optimal settings.
result TAD efficiently locates optimal settings with quantified uncertainty.
Optimizes sampling for faster convergence in Bayesian experimental design and uncertainty quantification.
problem Efficiently selecting samples for faster convergence in Bayesian experimental design and uncertainty quantification.
method Output-weighted acquisition functions leveraging likelihood ratio to guide sampling towards relevant regions.
result Superiority of the proposed method in uncertainty quantification and rare event identification.
This work introduces a new sampling method to approximate an optimal design problem in ridge regression.
problem Finding an optimal subset of predictors in ridge regression to minimize prediction error.
method Developed a λ λ λ -regularized proportional volume sampling algorithm with approximation guarantees. result The algorithm provides a ( 1 + ε 1 + λ ′ ) (1+\fracε{\sqrt{1+λ'}}) ( 1 + 1 + λ ′ ε ) -approximation for the optimal design problem. A new method designs batches for Bayesian optimization more efficiently.
problem Efficiently designing batches for Bayesian optimization to reduce total time.
method Minimal Terminal Variance (MTV) acquisition function, optimizing I-optimality criterion.
result MTV designs batches more efficiently than other methods, as shown by numerical experiments.
New methods optimize transport and sampling for neural networks.
problem Designing effective training losses for neural networks.
method Optimal transport and stochastic optimal control through Schrödinger bridge problem.
result Valid training losses can be designed with numerical advantages.
Paper proposes an unbiased optimization method for Bayesian experimental design.
problem Maximizing expected information gain in Bayesian experimental design.
method Randomized multilevel Monte Carlo (MLMC) method combined with stochastic gradient descent.
result An unbiased estimator for the gradient of expected information gain.
New algorithm selects optimal subset for multiclass classifier training.
problem Selecting optimal subset of labeled examples for multiclass classifier training.
method Regret minimization framework with new regularization scheme.
result New method consistently outperforms state-of-the-art approaches.
In experimental design, we are given a large collection of vectors, each with a hidden response value that we assume derives from an underlying linear model, and we wish to pick a small subset of the vectors such that querying the corresponding responses will lead to a good estimator of the model. A classical approach …
New method designs joint initial noises for diffusion models to improve diversity and alignment.
problem Independent initial noises limit diversity in generated images.
method Coupling of initial noises, maintaining Gaussian distribution while allowing dependence.
result Repulsive Gaussian coupling improves diversity without increasing sampling cost.
Automates optimizer design for diverse tasks efficiently.
problem Scalability, generability, and sample efficiency in optimizer search.
method Re-arranged optimizer space into a super-tree, applying tree traversal methods.
result Discover optimizers with only 128 evaluations, surpassing human-designed and prior methods.
PASOA optimizes Bayesian design by improving SMC samplers and EIG.
problem Sequential design optimization for accurate parameter inference.
method Sequential optimization using contrastive estimation, SMC samplers, and tempering.
result PASOA optimizes design and inference with improved consistency.
A faster method for optimizing DNA and protein sequences using machine learning.
problem Designing DNA and protein sequences with improved function.
method Activation maximization with a straight-through approximation and adaptive entropy variable.
result Fast SeqProp achieves up to 100-fold faster convergence and improved fitness optima.
vsOED optimizes experiment design with reinforcement learning for Bayesian models.
problem Optimizing the sequence of experiments in Bayesian models for efficient data collection.
method Reinforcement learning with variational posterior approximations to optimize design policy.
result vsOED achieves superior sample efficiency compared to existing methods.
New method uses diffusion models to optimize experimental design efficiently.
problem Optimizing experimental design for high-dimensional and complex settings.
method Introduces a pooled posterior distribution and uses diffusion-based samplers for efficient sampling and optimization.
result Extends Bayesian Optimal Experimental Design to practical scenarios.
Bayesian optimization provides sample-efficient global optimization for a broad range of applications, including automatic machine learning, engineering, physics, and experimental design. We introduce BoTorch, a modern programming framework for Bayesian optimization that combines Monte-Carlo (MC) acquisition functions,…
Bayesian methods improve drug discovery experiment design.
problem Optimizing drug screening experiments in high-dimensional data.
method Bayesian inference and optimisation with upper confidence bound algorithms, Thompson sampling, and sparse tree search.
result Sparse tree search techniques outperform other methods in drug toxicity screening.
Optimizes expensive experiments by incorporating expert knowledge.
problem Expensive experiments require minimizing the number of trials.
method Bayesian optimization with posterior sampling of expert knowledge.
result Demonstrates significant efficiency gains in experiments and hyperparameter tuning.
Novel neural architecture improves Bayesian experimental design efficiency.
problem Intractable evaluation of expected information gain (EIG) in Bayesian optimal experimental design.
method Develops a neural architecture that optimizes a single variational model for estimating EIG across many designs, using a lower bound for computational efficiency.
result Significantly improves accuracy in Bayesian experimental design with better sample efficiency.
P3BO optimizes biological sequence design by combining multiple methods.
problem Variability in performance of black-box optimization methods for biological sequence design.
method Population-Based Black-Box Optimization (P3BO) that samples sequences from an ensemble of methods, weighting by past performance.
result P3BO outperforms individual methods, proposing higher quality and more diverse sequences.
New method for identifying best designs in vector optimization with uncertain feedback.
problem Optimizing vector-valued outcomes with uncertain preferences.
method Stochastic bandit feedback, polyhedral ordering cone, ( ε , δ ε,δ ε , δ )-PAC Pareto set identification. result Sample complexity characterized and matched by the naïve elimination algorithm.
This study optimizes covariate density and propensity score for efficient ATE estimation.
problem Efficiently estimating average treatment effects (ATEs) with minimal variance.
method Adaptive experiment optimizing both covariate density and propensity score.
result Proposed method minimizes the semiparametric efficiency bound for ATE estimation.
This paper provides a general framework to study the effect of sampling properties of training data on the generalization error of the learned machine learning (ML) models. Specifically, we propose a new spectral analysis of the generalization error, expressed in terms of the power spectra of the sampling pattern and t…
This work improves molecular design by efficiently selecting diverse candidate molecules.
problem Designing molecules that satisfy multiple conflicting objectives.
method A modular 'generate-then-optimize' framework using generative models and a novel acquisition function.
result Significant improvements in sample efficiency across synthetic and application-driven tasks.
Optimizes experimental designs for intractable models using mutual information bounds.
problem Finding optimal experimental designs for models with intractable data-generating distributions.
method Maximizes mutual information lower bounds parametrized by neural networks, updating network parameters and designs simultaneously.
result Framework enables experimental design for various tasks including parameter estimation and model discrimination.
Unified algorithm for efficient pure exploration using dual variables.
problem Efficiently achieving a specific goal through adaptive experimentation.
method Introducing dual variables to derive optimal allocation conditions, leading to Information-Directed Selection.
result Top-two Thompson sampling attains asymptotic optimality for Gaussian best-arm identification.
Generative models learn distributions, new method finds inputs matching desired conditional distributions.
problem Designing inputs that produce specific conditional distributions, not just points.
method Conditional Distribution Matching (CDM) and MLGD-F algorithm.
result MLGD-F reliably recovers inputs matching diverse user-specified conditional distributions.
Optimizes balanced treatment assignment for experiments.
problem Balancing treatment groups in experiments for optimal results.
method Optimization of a two-sample test, using minimum spanning tree test.
result Optimal assignment algorithm with polynomial time complexity.
ARCO-BO optimizes multi-agent design under heterogeneity, improving efficiency and performance.
problem Heterogeneous multi-agent optimization challenges in resource use and information sharing.
method ARCO-BO integrates a consensus mechanism, budget-aware sampling, and partial input sharing for heterogeneous design spaces.
result ARCO-BO outperforms independent and collaborative BO methods in complex multi-agent settings.
Optimal sampling reduces power grid data analysis costs.
problem Efficient online analysis of high-speed, correlated IoT data.
method D-optimality criterion-based sampling methods combining Bernoulli and leverage score sampling.
result Leverage score sampling improves computational efficiency and outperforms benchmarks.
We consider in this paper the problem of optimal experiment design where a decision maker can choose which points to sample to obtain an estimate β ^ \hatβ β ^ of the hidden parameter β ⋆ β^{\star} β ⋆ of an underlying linear model. The key challenge of this work lies in the heteroscedasticity assumption that we make, meaning that…
We propose an input design method for a general class of parametric probabilistic models, including nonlinear dynamical systems with process noise. The goal of the procedure is to select inputs such that the parameter posterior distribution concentrates about the true value of the parameters; however, exact computation…
Bayesian optimization has become a fundamental global optimization algorithm in many problems where sample efficiency is of paramount importance. Recently, there has been proposed a large number of new applications in fields such as robotics, machine learning, experimental design, simulation, etc. In this paper, we foc…
Experimental design is a process of obtaining a product with target property via experimentation. Bayesian optimization offers a sample-efficient tool for experimental design when experiments are expensive. Often, expert experimenters have 'hunches' about the behavior of the experimental system, offering potentials to …
In this work, we propose a robust approach to design distributed controllers for unknown-but-sparse linear and time-invariant systems. By leveraging modern techniques in distributed controller synthesis and structured linear inverse problems as applied to system identification, we show that near-optimal distributed con…