Bayesian optimization for materials design

3 June 2015

Papers citing "Bayesian optimization for materials design"

33 / 83 papers shown

Title
Optimizing Bayesian acquisition functions in Gaussian Processes Ashish Anil Pawar Ujwal Warbhe GP 18 5 0 09 Nov 2021
Multi-Objective Constrained Optimization for Energy Applications via Tree Ensembles Alexander Thebelt Calvin Tsay Robert M. Lee Nathan Sudermann-Merx David Walz T. Tranter Ruth Misener AI4CE 56 30 0 04 Nov 2021
Combining Latent Space and Structured Kernels for Bayesian Optimization over Combinatorial Spaces Aryan Deshwal J. Doppa BDL 103 44 0 01 Nov 2021
Spiderweb nanomechanical resonators via Bayesian optimization: inspired by nature and guided by machine learning Dongil Shin Andrea Cupertino M. H. J. D. Jong P. Steeneken Miguel A. Bessa R. Norte 44 68 0 10 Aug 2021
Self-supervised optimization of random material microstructures in the small-data regime Maximilian Rixner P. Koutsourelakis AI4CE 46 15 0 05 Aug 2021
Reinforced Few-Shot Acquisition Function Learning for Bayesian Optimization Bing-Jing Hsieh Ping-Chun Hsieh Xi Liu 79 16 0 08 Jun 2021
Benchmarking the Performance of Bayesian Optimization across Multiple Experimental Materials Science Domains Qiaohao Liang Aldair E. Gongora Zekun Ren A. Tiihonen Zhe Liu ... K. Hippalgaonkar Benji Maruyama Keith A. Brown John W Fisher Iii Tonio Buonassisi 72 124 0 23 May 2021
Bayesian Optimization is Superior to Random Search for Machine Learning Hyperparameter Tuning: Analysis of the Black-Box Optimization Challenge 2020 Ryan Turner David Eriksson M. McCourt J. Kiili Eero Laaksonen Zhen Xu Isabelle M Guyon BDL 92 304 0 20 Apr 2021
A New Knowledge Gradient-based Method for Constrained Bayesian Optimization Wenjie Chen Shengcai Liu Ke Tang 52 7 0 20 Jan 2021
Combinatorial Bayesian Optimization with Random Mapping Functions to Convex Polytopes Jungtaek Kim Seungjin Choi Minsu Cho 125 6 0 26 Nov 2020
Bayesian Screening: Multi-test Bayesian Optimization Applied to in silico Material Screening J. Hook Calum Hand Emma Whitfield 8 0 0 11 Sep 2020
Scalable Combinatorial Bayesian Optimization with Tractable Statistical models Aryan Deshwal Syrine Belakaria J. Doppa 61 13 0 18 Aug 2020
BOSH: Bayesian Optimization by Sampling Hierarchically Henry B. Moss David S. Leslie Paul Rayson 66 8 0 02 Jul 2020
Bayesian Optimization with Missing Inputs P. Luong Dang Nguyen Sunil R. Gupta Santu Rana Svetha Venkatesh 60 3 0 19 Jun 2020
Additive stacking for disaggregate electricity demand forecasting Christian Capezza B. Palumbo Y. Goude S. Wood Matteo Fasiolo AI4TS 85 7 0 20 May 2020
Human Strategic Steering Improves Performance of Interactive Optimization Fabio Colella Pedram Daee Jussi P. P. Jokinen Antti Oulasvirta Samuel Kaski LLMSV 115 9 0 04 May 2020
Incorporating Expert Prior in Bayesian Optimisation via Space Warping Anil Ramachandran Sunil R. Gupta Santu Rana Cheng Li Svetha Venkatesh 57 36 0 27 Mar 2020
ENTMOOT: A Framework for Optimization over Ensemble Tree Models Alexander Thebelt Jan Kronqvist Miten Mistry Robert M. Lee Nathan Sudermann-Merx Ruth Misener 87 57 0 10 Mar 2020
Uncertainty Quantification for Bayesian Optimization Rui Tuo Wei Cao UQCV 57 5 0 04 Feb 2020
Investigating Active Learning and Meta-Learning for Iterative Peptide Design Rainier Barrett A. White 76 2 0 20 Nov 2019
Accelerating small-angle scattering experiments with simulation-based machine learning T. Kanazawa A. Asahara Hidekazu Morita 31 10 0 24 Aug 2019
Bayesian experimental design using regularized determinantal point processes Michal Derezinski Feynman T. Liang Michael W. Mahoney 48 26 0 10 Jun 2019
Bayesian Optimization of Composite Functions Raul Astudillo P. Frazier LLMAG 73 78 0 04 Jun 2019
Bayesian Optimization with Approximate Set Kernels Jungtaek Kim M. McCourt Tackgeun You Saehoon Kim Seungjin Choi 80 8 0 23 May 2019
Knowing The What But Not The Where in Bayesian Optimization Vu Nguyen Michael A. Osborne 104 38 0 07 May 2019
Learning Optimal Data Augmentation Policies via Bayesian Optimization for Image Classification Tasks Chunxu Zhang Jiaxu Cui Bo Yang 61 3 0 06 May 2019
A Tutorial on Bayesian Optimization P. Frazier GP 149 1,803 0 08 Jul 2018
Maximizing acquisition functions for Bayesian optimization James T. Wilson Frank Hutter M. Deisenroth 155 250 0 25 May 2018
Non-Stationary Bandits with Habituation and Recovery Dynamics Yonatan Dov Mintz A. Aswani Philip M. Kaminsky E. Flowers Yoshimi Fukuoka 227 57 0 26 Jul 2017
Warm Starting Bayesian Optimization Matthias Poloczek Jialei Wang P. Frazier 110 61 0 11 Aug 2016
Multi-Step Bayesian Optimization for One-Dimensional Feasibility Determination J. M. Cashore Lemuel Kumarga P. Frazier 52 7 0 11 Jul 2016
Parallel Bayesian Global Optimization of Expensive Functions Jialei Wang Scott C. Clark Eric Liu P. Frazier 81 161 0 16 Feb 2016
Stratified Bayesian Optimization Saul Toscano-Palmerin P. Frazier 44 5 0 07 Feb 2016