Φορτώνει......
Bayesian Calibration of Coarse-Grained Forces: Efficiently Addressing Transferability
Generating and calibrating forces that are transferable across a range of state-points remains a challenging task in coarse-grained (CG) molecular dynamics (MD). In this work, we present a coarse-graining workflow, inspired by ideas from uncertainty quantification and numerical analysis, to address...
Αποθηκεύτηκε σε:
| Τόπος έκδοσης: | J Chem Phys |
|---|---|
| Κύριοι συγγραφείς: | , , |
| Μορφή: | Artigo |
| Γλώσσα: | Inglês |
| Έκδοση: |
2016
|
| Θέματα: | |
| Διαθέσιμο Online: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5087108/ https://ncbi.nlm.nih.gov/pubmed/27389203 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4945380 |
| Ετικέτες: |
Προσθήκη ετικέτας
Δεν υπάρχουν, Καταχωρήστε ετικέτα πρώτοι!
|