Uncertainty quantification in MD simulations. II: Bayesian inference of force-field parameters (Q4917790)
From MaRDI portal
!
This is the item page for this Wikibase entity, intended for internal use and editing purposes. Please use the normal view instead:
scientific article; zbMATH DE number 6160068
| Language | Label | Description | Also known as |
|---|---|---|---|
| default for all languages | No label defined |
||
| English | Uncertainty quantification in MD simulations. II: Bayesian inference of force-field parameters |
scientific article; zbMATH DE number 6160068 |
Statements
Uncertainty Quantification in MD Simulations. Part II: Bayesian Inference of Force-Field Parameters (English)
0 references
2 May 2013
0 references
uncertainty quantification
0 references
inverse problem
0 references
Bayesian inference
0 references
polynomial chaos
0 references
molecular dynamics
0 references
TIP4P water
0 references
surrogate model
0 references
0.8238491415977478
0 references
0.694231390953064
0 references
0.6895855069160461
0 references
0.660811722278595
0 references
0.6588596105575562
0 references
