Commits · 42f47afde70bef307484ee8372521ddcbe9a3e16 · qbox / qbox-public · GitLab

01 Feb, 2016 1 commit
- Moved sync_positions and sync_velocities calls to the AtomSet set_positions · 6e6c912a
```
and set_velocities functions


git-svn-id: http://qboxcode.org/svn/qb/trunk@1801 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Feb 01, 2016
  6e6c912a Browse File
18 Sep, 2011 1 commit
- modified velocity rescaling alg, enforce constraints on velocity, · 0535f829
```
use a common ionic mass


git-svn-id: http://qboxcode.org/svn/qb/trunk@988 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Sep 18, 2011
  0535f829 Browse File
30 Apr, 2009 1 commit

Blocked MD dynamics · bc5c618e


git-svn-id: http://qboxcode.org/svn/qb/trunk@691 cba15fb0-1239-40c8-b417-11db7ca47a34

committed Apr 30, 2009

bc5c618e Browse File