Md nsteps
Revision as of 11:01, 18 July 2021 by Miguel Caro (talk | contribs)
Number of molecular dynamics steps to run. The total duration of the MD run is this number times md_step.
Summary
| Required/optional | Type | Accepted values | Default | See also |
|---|---|---|---|---|
| Required for MD | Integer | Any positive integer | None | Molecular dynamics, md_step
|
Example
md_nsteps = 10000
