admin | Wed, 03/15/2017 - 10:23
These conformer models aim to generate bioactive conformers,which would be found in protein-ligand complexes. For this reason, these conformers are often very different from their experimental structures determined in the gas phase
How do you choose which are best? Both, from the perspective of creating them for the databank, and for using them as a client (in your research).
Item URL:
https://hypothes.is/a/XZtzDgmTEeejNzPHcn7bCg