% Key papers for Acquisition function design (scime atlas, https://atlas.scime.ai). Authors are not included: add them from the paper pages. @inproceedings{neurips2016_bayesian_55596, title = {{Bayesian Optimization with Robust Bayesian Neural Networks}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2016}, url = {https://nips.cc/virtual/2016/poster/7420}, } @inproceedings{neurips2017_practical_56582, title = {{Practical Bayesian Optimization for Model Fitting with Bayesian Adaptive Direct Search}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2017}, url = {https://nips.cc/virtual/2017/poster/8973}, } @inproceedings{icml2018_stagewise_37000, title = {{Stagewise Safe Bayesian Optimization with Gaussian Processes}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2018}, url = {https://icml.cc/virtual/2018/poster/2466}, } @inproceedings{neurips2018_maximizing_57360, title = {{Maximizing acquisition functions for Bayesian optimization}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2018}, url = {https://nips.cc/virtual/2018/poster/11938}, } @inproceedings{icml2017_high_36216, title = {{High Dimensional Bayesian Optimization with Elastic Gaussian Process}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2017}, url = {https://icml.cc/virtual/2017/poster/554}, } @inproceedings{neurips2016_bayesian_55600, title = {{Bayesian optimization under mixed constraints with a slack-variable augmented Lagrangian}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2016}, url = {https://nips.cc/virtual/2016/poster/7261}, } @inproceedings{neurips2023_unexpected_66638, title = {{Unexpected Improvements to Expected Improvement for Bayesian Optimization}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2023}, url = {https://nips.cc/virtual/2023/poster/72985}, } @inproceedings{icml2017_preferential_36345, title = {{Preferential Bayesian Optimization}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2017}, url = {https://icml.cc/virtual/2017/poster/565}, } @inproceedings{neurips2016_batched_55593, title = {{Batched Gaussian Process Bandit Optimization via Determinantal Point Processes}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2016}, url = {https://nips.cc/virtual/2016/poster/7162}, } @inproceedings{neurips2017_lookahead_56457, title = {{Lookahead Bayesian Optimization with Inequality Constraints}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2017}, url = {https://nips.cc/virtual/2017/poster/8978}, } @inproceedings{neurips2020_multi_60354, title = {{Multi-Fidelity Bayesian Optimization via Deep Neural Networks}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2020}, url = {https://nips.cc/virtual/2020/poster/17561}, } @inproceedings{neurips2017_process_56597, title = {{Process-constrained batch Bayesian optimisation}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2017}, url = {https://nips.cc/virtual/2017/poster/9125}, } @inproceedings{neurips2019_practical_58822, title = {{Practical Two-Step Lookahead Bayesian Optimization}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2019}, url = {https://nips.cc/virtual/2019/poster/14009}, } @inproceedings{neurips2018_automating_56883, title = {{Automating Bayesian optimization with Bayesian optimization}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2018}, url = {https://nips.cc/virtual/2018/poster/11581}, } @inproceedings{aaai2021_mercer_980, title = {{Mercer Features for Efficient Combinatorial Bayesian Optimization}}, booktitle = {AAAI Conference on Artificial Intelligence (AAAI)}, year = {2021}, url = {https://aaai.org/papers/07210-mercer-features-for-efficient-combinatorial-bayesian-optimization/}, } @inproceedings{aaai2018_bayesian_102563, title = {{Bayesian Functional Optimization}}, booktitle = {AAAI Conference on Artificial Intelligence (AAAI)}, year = {2018}, url = {https://ojs.aaai.org/index.php/AAAI/article/view/11830}, } @inproceedings{icml2020_a_37880, title = {{A Quantile-based Approach for Hyperparameter Transfer Learning}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2020}, url = {https://icml.cc/virtual/2020/poster/6483}, } @inproceedings{aaai2021_top_1517, title = {{Top-k Ranking Bayesian Optimization}}, booktitle = {AAAI Conference on Artificial Intelligence (AAAI)}, year = {2021}, url = {https://aaai.org/papers/09135-top-k-ranking-bayesian-optimization/}, } @inproceedings{icml2017_local_36274, title = {{Local Bayesian Optimization of Motor Skills}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2017}, url = {https://icml.cc/virtual/2017/poster/748}, } @inproceedings{icml2020_knowing_38354, title = {{Knowing The What But Not The Where in Bayesian Optimization}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2020}, url = {https://icml.cc/virtual/2020/poster/6137}, } @inproceedings{iclr2024_a_34459, title = {{A Study of Bayesian Neural Network Surrogates for Bayesian Optimization}}, booktitle = {International Conference on Learning Representations (ICLR)}, year = {2024}, url = {https://iclr.cc/virtual/2024/poster/18615}, } @inproceedings{neurips2024_cost_71972, title = {{Cost-aware Bayesian Optimization via the Pandora's Box Gittins Index}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2024}, url = {https://neurips.cc/virtual/2024/poster/95339}, } @inproceedings{neurips2024_transition_73143, title = {{Transition Constrained Bayesian Optimization via Markov Decision Processes}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2024}, url = {https://neurips.cc/virtual/2024/poster/94288}, } @inproceedings{aaai2024_stochastic_7419, title = {{Stochastic Bayesian Optimization with Unknown Continuous Context Distribution via Kernel Density Estimation}}, booktitle = {AAAI Conference on Artificial Intelligence (AAAI)}, year = {2024}, url = {https://ojs.aaai.org/index.php/AAAI/article/view/29158}, } @inproceedings{aaai2025_boids_8218, title = {{BOIDS: High-Dimensional Bayesian Optimization via Incumbent-Guided Direction Lines and Subspace Embeddings}}, booktitle = {AAAI Conference on Artificial Intelligence (AAAI)}, year = {2025}, url = {https://ojs.aaai.org/index.php/AAAI/article/view/34165}, } @inproceedings{aaai2025_regional_10499, title = {{Regional Expected Improvement for Efficient Trust Region Selection in High-Dimensional Bayesian Optimization}}, booktitle = {AAAI Conference on Artificial Intelligence (AAAI)}, year = {2025}, url = {https://ojs.aaai.org/index.php/AAAI/article/view/34161}, } @inproceedings{iclr2024_a_34301, title = {{A General Framework for User-Guided Bayesian Optimization}}, booktitle = {International Conference on Learning Representations (ICLR)}, year = {2024}, url = {https://iclr.cc/virtual/2024/poster/18774}, } @inproceedings{iclr2024_adversarial_34657, title = {{Adversarial Causal Bayesian Optimization}}, booktitle = {International Conference on Learning Representations (ICLR)}, year = {2024}, url = {https://iclr.cc/virtual/2024/poster/18417}, } @inproceedings{icml2024_in_44560, title = {{In-Context Freeze-Thaw Bayesian Optimization for Hyperparameter Optimization}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2024}, url = {https://icml.cc/virtual/2024/poster/33892}, } @inproceedings{icml2024_boundary_44990, title = {{Boundary Exploration for Bayesian Optimization With Unknown Physical Constraints}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2024}, url = {https://icml.cc/virtual/2024/poster/33462}, } @inproceedings{iclr2025_standard_83235, title = {{Standard Gaussian Process is All You Need for High-Dimensional Bayesian Optimization}}, booktitle = {International Conference on Learning Representations (ICLR)}, year = {2025}, url = {https://iclr.cc/virtual/2025/poster/28574}, } @inproceedings{aaai2025_coffeeboost_8445, title = {{CoffeeBoost: Gradient Boosting Native Conformal Inference for Bayesian Optimization}}, booktitle = {AAAI Conference on Artificial Intelligence (AAAI)}, year = {2025}, url = {https://ojs.aaai.org/index.php/AAAI/article/view/33982}, } @inproceedings{aaai2025_modeling_9980, title = {{Modeling All Response Surfaces in One for Conditional Search Spaces}}, booktitle = {AAAI Conference on Artificial Intelligence (AAAI)}, year = {2025}, url = {https://ojs.aaai.org/index.php/AAAI/article/view/34016}, } @inproceedings{icml2024_malibo_43388, title = {{MALIBO: Meta-learning for Likelihood-free Bayesian Optimization}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2024}, url = {https://icml.cc/virtual/2024/poster/35064}, } @inproceedings{icml2024_accelerating_43416, title = {{Accelerating Look-ahead in Bayesian Optimization: Multilevel Monte Carlo is All you Need}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2024}, url = {https://icml.cc/virtual/2024/poster/35036}, } @inproceedings{icml2024_bayesian_45550, title = {{Bayesian Optimization of Function Networks with Partial Evaluations}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2024}, url = {https://icml.cc/virtual/2024/poster/32902}, } @inproceedings{icml2025_funbo_47649, title = {{FunBO: Discovering Acquisition Functions for Bayesian Optimization with FunSearch}}, booktitle = {International Conference on Machine Learning (ICML)}, year = {2025}, url = {https://icml.cc/virtual/2025/poster/44948}, } @inproceedings{neurips2024_inversion_72334, title = {{Inversion-based Latent Bayesian Optimization}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2024}, url = {https://neurips.cc/virtual/2024/poster/95013}, } @inproceedings{neurips2024_batched_74413, title = {{Batched Energy-Entropy acquisition for Bayesian Optimization}}, booktitle = {Advances in Neural Information Processing Systems (NeurIPS)}, year = {2024}, url = {https://neurips.cc/virtual/2024/poster/93157}, } @inproceedings{iclr2025_optimistic_84057, title = {{Optimistic Games for Combinatorial Bayesian Optimization with Application to Protein Design}}, booktitle = {International Conference on Learning Representations (ICLR)}, year = {2025}, url = {https://iclr.cc/virtual/2025/poster/27768}, }