| First-passage times in complex energy landscapes: a case study with nonmuscle myosin II assembly | Apr 7, 2022 | Protein Folding | —Unverified | 0 |
| A 23 MW data centre is all you need | Mar 31, 2022 | AllBoard Games | —Unverified | 0 |
| Disentangled Spatiotemporal Graph Generative Models | Feb 28, 2022 | DisentanglementFunctional Connectivity | —Unverified | 0 |
| From evolution to folding of repeat proteins | Feb 24, 2022 | Protein Folding | —Unverified | 0 |
| Collective Variable for Metadynamics Derived from AlphaFold Output | Feb 17, 2022 | PredictionProtein Folding | —Unverified | 0 |
| Prompt-Guided Injection of Conformation to Pre-trained Protein Model | Feb 7, 2022 | Language ModelingLanguage Modelling | —Unverified | 0 |
| DrugOOD: Out-of-Distribution (OOD) Dataset Curator and Benchmark for AI-aided Drug Discovery -- A Focus on Affinity Prediction Problems with Noise Annotations | Jan 24, 2022 | BenchmarkingDrug Discovery | CodeCode Available | 0 |
| GraphVAMPNet, using graph neural networks and variational approach to markov processes for dynamical modeling of biomolecules | Jan 12, 2022 | Graph Representation Learningmolecular representation | —Unverified | 0 |
| RoMA: a Method for Neural Network Robustness Measurement and Assessment | Oct 21, 2021 | Protein Folding | —Unverified | 0 |
| Protein Folding Neural Networks Are Not Robust | Sep 9, 2021 | Adversarial AttackProtein Folding | —Unverified | 0 |
