Menu

Commit [r26110]  Maximize  Restore  History

Extended the Structure.test_align system test to throughly check the structural data.

This includes changing the structure.align user function call to use 'fit to first' and carefully
checking the new atomic coordinates.

bugman 2014-10-01

changed /trunk/test_suite/system_tests/structure.py
/trunk/test_suite/system_tests/structure.py Diff Switch to side-by-side view
Loading...
Want the latest updates on software, tech news, and AI?
Get latest updates about software, tech news, and AI from SourceForge directly in your inbox once a month.