[Xplor-nih] structure of protein with ligand

[Irina Nesmelova]

Hello,

I want to calculate a structure of protein dimer, in which each of the monomers has ligand - non-peptidic small molecule. I have a pdb file for ligand. How should I the information about ligand into python script? If someone has an example of pyhton script for similar system, I would greatly appreciate it.
Thank you,
Irina Nesmelova.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://dcb.cit.nih.gov/pipermail/xplor-nih/attachments/20080104/2bcd0a86/attachment.html