Research map / Probabilistic and scientific modeling / Dynamical systems
Spectral Learning of Dynamic Systems from Nonequilibrium Data
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Measured effects reported in the paper
| What was changed | Where | Measured | Effect |
|---|---|---|---|
| Enforce equilibrium constraint (solve for equilibrium initial vector omega_eq via quadratic program) on spectral-learned OOM | discrete OOM spectral learning from nonequilibrium data · Brownian dynamics two-well process | statistical bias in Prob_I / Prob_II estimates | Helped |
| Use binless spectral learning instead of binned/density-based estimators for continuous data | continuous OOM learning on nonequilibrium data · Brownian dynamics stationary distribution | accuracy of stationary distribution estimate | Helped |
| Use binless spectral learning for continuous data | continuous OOM learning on 2D diffusion · 2D diffusion TICA eigenvector estimation | estimation error of w_TICA | Helped |
| Use binless spectral learning instead of other estimators | molecular dynamics of alanine dipeptide · alanine dipeptide stationary distribution pi | estimation error of pi | Helped |
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