BIOVIAMolecular Modeling
Fragment-Based Drug Design in Discovery Studio
This course covers approaches for successful fragment-based lead optimization. Topics include fragment generation, analysis, and identification of fragment scaffolds from ligand libraries; as well as growing, replacing, and placing fragments within a protein target.
- Level
- Fundamental
- Length
- 8 hours
- Product
- Discovery Studio
- Format
- Instructor-ledOnsite or Virtual Classroom
Topics covered
- Introduction to Fragment-Based Drug Design
- Working with fragments and proteins in Discovery Studio
- Preparation (Retrosynthetic Combinatorial Analysis Procedure (ReCAP) approach)
- Analysis
- Fragment-based drug design modes
- REPLACE, GROW, PLACE
Prerequisites
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