Commit | Date | |
---|---|---|
[r5291]
by
bugman
Modifications to the structure.read_pdb() user function. The 'parser' argument has been added to allow different PDB parsers to be selected in the future. |
2008-04-04 12:13:28 | Tree |
[r5290]
by
bugman
Started to create the structural object and the API for accessing, creating, modifying info. |
2008-04-04 10:01:52 | Tree |
[r5289]
by
bugman
Started to create the structure package. The package is now initialised and has a docstring describing it. The structure module has also |
2008-04-04 09:25:38 | Tree |
2008-04-04 09:14:11 | Tree | |
[r5287]
by
bugman
The fn physical_constants.return_atomic_mass() is now used instead of the old atomic_mass() fn. |
2008-04-04 09:13:40 | Tree |
[r5286]
by
bugman
Updated physical_constants.return_atomic_mass() to better match generic_fns.structure.atomic_mass(). |
2008-04-04 09:12:13 | Tree |
[r5285]
by
bugman
Created a new directory for the new 'structure' package. This will eventually contain numerous structure related operations including: A number of PDB parsers, This package will eventually have a well defined API for accessing structural data independent of |
2008-04-04 09:09:57 | Tree |
2008-04-04 08:59:15 | Tree | |
2008-04-03 21:10:44 | Tree | |
2008-04-03 21:07:22 | Tree |