awesome-offline-model-based-optimization
github.com/mila-iqia/awesome-offline-model-based-optimization ↗📰 [TMLR 2026 Survey Certification] Must-Read Papers on Offline Model-Based Optimization 🔥
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Latest Updates🔗 Benchmark🎯 Surrogate Modeling🤔 Generative Modeling
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🔗 Benchmark
- A Benchmark of Kriging-Based Infill Criteria for Noisy OptimizationTask
- Accelerating Bayesian Optimization for Biological Sequence Design with Denoising AutoencodersTask
- Activity-Enhancing Mutations in an E3 Ubiquitin Ligase Identified by High-Throughput MutagenesisTask
- A Framework for Exhaustively Mapping Functional Missense VariantsTask
- A Literature Survey of Benchmark Functions for Global Optimization ProblemsTask
- An Easy-to-Use Real-World Multi-Objective Optimization Problem SuiteTask
Latest Updates
🤔 Generative Modeling
- AffinityFlow: Guided Flows for Antibody Affinity Maturation
- Automatic Chemical Design using a Data-Driven Continuous Representation of Molecules
- Biological Sequence Design with GFlowNets
- Bootstrapped Training of Score-Conditioned Generator for Offline Design of Biological Sequences
- Conditioning by Adaptive Sampling for Robust Design
- Conservative Objective Models Are a Special Kind of Contrastive Divergence-Based Energy Model
🎯 Surrogate Modeling
- Autofocused Oracles for Model-Based Design
- Bidirectional Learning for Offline Infinite-Width Model-Based Optimization
- Bidirectional Learning for Offline Model-Based Biological Sequence Design
- Boosting Offline Optimizers with Surrogate Sensitivity
- Conflict-Averse Gradient Optimization of Ensembles for Effective Offline Model-Based Optimization
- Conservative Objective Models for Effective Offline Model-Based Optimization
Showing a sample of 87 resources. View the full list on GitHub →