Contents
Release 4.5, June 2000
1. Introduction
2. Theory
- Site Search
- Conformational Search
- Ligand Fitting
- Ligand Scoring
3. Methodology
- Site Search
- Fit Ligands
- Multiple ligands
- Ligand Scoring
4. Tutorials
- Description of the lessons in this chapter
- Access to the lessons as log files
- Lesson 1: splitting a protein/ligand complex into separate models
- Lesson 2: performing a rigid fit
- Lesson 3: fitting a number of ligands to a single active site
- Lesson 4: scoring ligands after fitting
- Lesson 5: Performing a flexible fit
A. References
Last updated May 18, 2000 at 04:45PM Pacific Daylight Time.
Copyright © 2000, Molecular Simulations Inc. All rights
reserved.