Commit | Date | |
---|---|---|
[r5838]
by
bugman
Shifted the XH vector calculation from the xh_vector() structural API method to the vector() fn. This calculation can be done independently from the type of the structural data object. |
2008-04-20 11:26:25 | Tree |
2008-04-20 10:55:22 | Tree | |
2008-04-20 10:54:02 | Tree | |
2008-04-20 10:52:51 | Tree | |
[r5834]
by
bugman
Renamed generate_spin_id() to generate_spin_id_data_array(), and created a new generate_spin_id(). The generate_spin_id_data_array() function generates the spin_id string from a data array whereas |
2008-04-20 10:51:34 | Tree |
2008-04-20 10:45:08 | Tree | |
2008-04-20 10:31:59 | Tree | |
[r5831]
by
bugman
Fixed the angles.py script used in the system tests. The heteronuc arg to structure.vectors() has been removed. |
2008-04-20 10:29:25 | Tree |
[r5830]
by
bugman
Modified the structural API stub method atom_loop() to accept the model_num_flag arg. |
2008-04-20 10:25:41 | Tree |
[r5829]
by
bugman
Modified the Scientific Python API atom_loop() method to return the model number when asked. |
2008-04-20 10:23:56 | Tree |