Atomistic Description on HIV dataset
Metric: AUC (higher is better)
Metric: AUC (higher is better)
| # | Model↕ | AUC▼ | Extra Data | Paper | Date↕ | Code |
|---|---|---|---|---|---|---|
| 1 | DVMP | 0.81 | No | Dual-view Molecule Pre-training | 2021-06-17 | Code |
| 2 | Uni-Mol | 0.808 | No | Galactica: A Large Language Model for Science | 2022-11-16 | Code |
| 3 | ChemBFN | 0.794 | No | A Bayesian Flow Network Framework for Chemistry ... | 2024-07-28 | Code |
| 4 | ChemBERTa-2 Fine-tuned | 0.793 | No | - | - | Code |
| 5 | SMA | 0.789 | No | Self-Guided Masked Autoencoders for Domain-Agnos... | 2024-02-22 | Code |
| 6 | MolXPT | 0.781 | No | MolXPT: Wrapping Molecules with Text for Generat... | 2023-05-18 | Code |
| 7 | GAL 30B | 0.759 | No | Galactica: A Large Language Model for Science | 2022-11-16 | Code |
| 8 | GAL 120B | 0.745 | No | Galactica: A Large Language Model for Science | 2022-11-16 | Code |
| 9 | GAL 1.3B | 0.724 | No | Galactica: A Large Language Model for Science | 2022-11-16 | Code |
| 10 | GAL 6.7B | 0.722 | No | Galactica: A Large Language Model for Science | 2022-11-16 | Code |
| 11 | GAL 125M | 0.702 | No | Galactica: A Large Language Model for Science | 2022-11-16 | Code |