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Commit Date  
[r8591] by bugman

Created, by 'svn cp', the mf_csa module.

2009-01-22 14:02:59 Tree
[r8590] by bugman

Copyright updates.

2009-01-22 14:01:11 Tree
[r8589] by bugman

Fixes for create_vector_dist() for the new structural data design.

The atoms are added to the single molecule, and the struct_index has been eliminated.

2009-01-22 13:59:41 Tree
[r8588] by bugman

Fix for the Internal.add_molecule() method.

The orig_mol_num structure must be a list!

2009-01-22 13:56:15 Tree
[r8587] by bugman

Docstring fix for pack_structs().

2009-01-22 13:54:21 Tree
[r8586] by bugman

Fix for create_vector_dist().

The presence of structures now is tested using cdp.structure.num_models().

2009-01-22 13:47:36 Tree
[r8585] by bugman

Modified load_spins() to handle spin systems with the molecule unnamed.

If loading spins from a PDB file is used but the sequence already loaded (without the molecule ID
string), the molecule ID is now set instead of a new molecule container created.

2009-01-22 13:36:04 Tree
[r8584] by bugman

Fix for a RelaxError print out.

2009-01-22 13:18:51 Tree
[r8583] by bugman

Updated all the files in maths_fns/ to the 1.2.10 branched ellipsoidal CS tensor code.

This code comes from Pavel Kaderavek <kada att chemi dot muni dot cz> and is located at
https://www.ncbr.chemi.muni.cz/~kada/relax-1.2.10_cst.tar.

The 'mf_csa.py' file has been excluded for now.

2009-01-22 13:15:02 Tree
[r8582] by bugman

Added all the files, by 'svn cp', needed for the 1.2.10 branched ellipsoidal CS tensor code.

This is guessing the origin of files in https://www.ncbr.chemi.muni.cz/~kada/relax-1.2.10_cst.tar.
This maths_fns/ code comes from Pavel Kaderavek <kada att chemi dot muni dot cz>.

2009-01-22 13:11:24 Tree
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