ReleaseNotes092 - MDAnalysis/mdanalysis GitHub Wiki

This is a patch release of MDAnalysis, which contains a couple of small enhancements.

CHANGELOG

• 0.9.2
• released 04/20/15

Enhancements

• Can now set velocity from Atom object. (Issue #221)
• Atom object now has force attribute for getting/setting forces (requires a trajectory with forces) (Issue #221)
• Added wrap method. Wrap allows the centers of groups of atoms to be moved within the primary unit cell without breaking up the group. (Issue #190)

Changes

• The MDAnalysis project moved from Google Code to GitHub: the new website is http://www.mdanalysis.org and the new source code repository is at https://github.com/MDAnalysis/mdanalysis
• "applications" were removed from the mdanalysis source code repository and now exist as independent repositories under https://github.com/MDAnalysis/
• Using a non-existent atom name as an instant selector now raises AttributeError instead of SelectionError (Issue #220)

Fixes

• trajectory objects are now properly closed in unit tests (Issue #256)

Authors

tyler.je.reddy, richardjgowers, orbeckst