| Multi-level Protein Representation Learning for Blind Mutational Effect Prediction | Jun 8, 2023 | Protein FoldingRepresentation Learning | —Unverified | 0 |
| Machine learning in and out of equilibrium | Jun 6, 2023 | NavigateProtein Folding | CodeCode Available | 0 |
| AbODE: Ab Initio Antibody Design using Conjoined ODEs | May 31, 2023 | Graph MatchingProtein Folding | —Unverified | 0 |
| Inverse Protein Folding Using Deep Bayesian Optimization | May 25, 2023 | Bayesian OptimizationProtein Folding | —Unverified | 0 |
| Understanding the Capabilities of Large Language Models for Automated Planning | May 25, 2023 | Protein Folding | —Unverified | 0 |
| Folding@home: achievements from over twenty years of citizen science herald the exascale era | Mar 15, 2023 | Distributed ComputingGPU | —Unverified | 0 |
| Two for One: Diffusion Models and Force Fields for Coarse-Grained Molecular Dynamics | Feb 1, 2023 | Protein Folding | —Unverified | 0 |
| Solving the HP model with Nested Monte Carlo Search | Jan 23, 2023 | Protein Folding | —Unverified | 0 |
| On the Robustness of AlphaFold: A COVID-19 Case Study | Jan 10, 2023 | Protein Folding | —Unverified | 0 |
| Deep learning applied to computational mechanics: A comprehensive review, state of the art, and the classics | Dec 18, 2022 | Gaussian ProcessesMisconceptions | —Unverified | 0 |
| Economic impacts of AI-augmented R&D | Dec 15, 2022 | Deep LearningDrug Discovery | —Unverified | 0 |
| Reinforcement Learning for Molecular Dynamics Optimization: A Stochastic Pontryagin Maximum Principle Approach | Dec 6, 2022 | Decision MakingDrug Discovery | CodeCode Available | 0 |
| Applying Deep Reinforcement Learning to the HP Model for Protein Structure Prediction | Nov 27, 2022 | Deep Reinforcement LearningProtein Folding | CodeCode Available | 0 |
| Invariance-Aware Randomized Smoothing Certificates | Nov 25, 2022 | Molecular Property PredictionProperty Prediction | —Unverified | 0 |
| Friends in need: how chaperonins recognize and remodel proteins that require folding assistance | Nov 16, 2022 | Protein Folding | —Unverified | 0 |
| Variational Quantum Algorithms for Chemical Simulation and Drug Discovery | Nov 15, 2022 | Drug DiscoveryProtein Folding | —Unverified | 0 |
| Rethinking the protein folding problem from a new perspective | Oct 10, 2022 | Protein Folding | —Unverified | 0 |
| Generalization Properties of Retrieval-based Models | Oct 6, 2022 | Protein FoldingRetrieval | —Unverified | 0 |
| Geometric Signatures of Switching Behavior in Mechanobiology | Sep 7, 2022 | Protein Folding | —Unverified | 0 |
| GANs and Closures: Micro-Macro Consistency in Multiscale Modeling | Aug 23, 2022 | Dimensionality ReductionProtein Folding | —Unverified | 0 |
| Protein Folding: From Classical Issues to a New Perspective | Aug 5, 2022 | Protein Folding | —Unverified | 0 |
| Selectivity of Protein Interactions Stimulated by Terahertz Signals | Jul 4, 2022 | Protein Folding | —Unverified | 0 |
| Molecular information theory meets protein folding | Jun 29, 2022 | Protein Folding | —Unverified | 0 |
| Learning Geometrically Disentangled Representations of Protein Folding Simulations | May 20, 2022 | Protein Folding | —Unverified | 0 |
| Chetaev Instability Framework for Kinetostatic Compliance-Based Protein Unfolding | May 15, 2022 | Protein Folding | —Unverified | 0 |