EuroMUG '02 -- 25 - 26 Sept, 2002

SMILES Strings and Ligand Refinement in BUSTER/TNT

Eric Blanc
Global Phasing


The drug discovery process involves the transfer of stereochemical information about the drug candidate to the crystallographic structure solution and back. A preliminary version of a piece of software facilitating such information transfer is presented.

Presentation slides:

Daylight Chemical Information Systems, Inc.