Automated Database Preparation: Difference between revisions
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== | ==Automatic Database Preparation Overview== | ||
* | *Scenario: You want to generate your own hierarchy databases as ligand inputs to DOCK 3.5 | ||
* | *See XXX if you want to automatically build a dockable database. | ||
*See YYY if you want to automatically generate decoys | |||
set of ligands, either in smiles or some other type easily converted to smile. | |||
* | |||
==Section 2== | ==Section 2== |
Revision as of 20:20, 29 October 2008
Automatic Database Preparation Overview
- Scenario: You want to generate your own hierarchy databases as ligand inputs to DOCK 3.5
- See XXX if you want to automatically build a dockable database.
- See YYY if you want to automatically generate decoys
set of ligands, either in smiles or some other type easily converted to smile.
Section 2
- bullet3
- bullet4