Rollout Simulation on MD17 Eth+Mal+Asp
0Energy Variance (EV)Joint FT SB
Evaluation results
| Method | Links | ||
|---|---|---|---|
| Joint FT SBBackbone=M3GNet, Time Steps=1000, Forward Simulations=52026.06 | 0 | 0.61 | |
| Joint FTBackbone=M3GNet, Time Steps=1000, Forward Simulations=52026.06 | 0 | 0.56 | |
| GFFMergeBackbone=M3GNet, Time Steps=1000, Forward Simulations=52026.06 | 0 | 0.59 | |
| EMRBackbone=M3GNet, Time Steps=1000, Forward Simulations=52026.06 | 0 | 0.72 | |
| Wt AvgBackbone=M3GNet, Time Steps=1000, Forward Simulations=52026.06 | 0 | 0.68 | |
| TIESBackbone=M3GNet, Time Steps=1000, Forward Simulations=52026.06 | 0 | 0.67 | |
| FisherBackbone=M3GNet, Time Steps=1000, Forward Simulations=52026.06 | 0 | 0.67 |