[PyMOL] real time minization in Pymol

[Albert <mai...@gm...>]

Hello:

I just found a a very nice module of pymol, called "Molecular 
Sculpting". However, according to the description in Pymolwiki, it works 
like a real-time energy minimizer, except that it isn't minimizing the 
energy. Instead, its just trying to return local atomic geometries 
(bonds, angles, chirality, planarity) to the configuration the molecules 
possess when they were first loaded into PyMOL.

So I am just wondering does the developer have any planning to improve 
this nice too? For instance introducing forcefiled for this tool (eg: 
Amber FF for protein, GAFF for the ligand). There is a "optimize" plugin 
in Pymol, maybe the developer can consider merge them together?

Thank you very much

Albert