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Latest
Advances in Computational Drug Discovery – Role of Shape &
Electrostatics
Just Posted!
Shape and Electrostatics in Ligand based design: Virtual
screening and lead hopping, Dr. Paul Hawkins. Presentation
Video
Talks
Can computational chemistry make a
difference? A
retrospective look at 18 years in drug discovery. Dr. Christopher
Bayly, OpenEye Scientific. Download
An Introduction to Shape & Electrostatics. The application
of rigid methods in drug design. Dr. Paul Hawkins, OpenEye Scientific. Download
The importance of well-validated test sets in SBDD, Dr.
Gregory Warren, OpenEye Scientific. Download
Structure based design (SBDD), Dr. Gregory Warren. Download
Shape and Electrostatics in Ligand based design: Virtual
screening and lead hopping, Dr. Paul Hawkins. Prez Download
Understanding water in the binding site: SZMAP, Gameplan,
& SZYBKI, Dr. Christopher Bayly. Download
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