An ergodic sampling scheme for constrained Hamiltonian systems with applications to molecular dynamics (Q2482261): Difference between revisions
From MaRDI portal
Created a new Item |
Added link to MaRDI item. |
||
| links / mardi / name | links / mardi / name | ||
Revision as of 02:46, 3 February 2024
scientific article
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | An ergodic sampling scheme for constrained Hamiltonian systems with applications to molecular dynamics |
scientific article |
Statements
An ergodic sampling scheme for constrained Hamiltonian systems with applications to molecular dynamics (English)
0 references
16 April 2008
0 references
molecular dynamics
0 references
canonical ensemble
0 references
hybrid Monte-Carlo
0 references
holonomic constraints
0 references
free energy calculation
0 references
