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B Pharm Computer Aided Drug Design Unit 3 PDF Notes


B-Pharmas, unlock the virtual world of drug discovery in B Pharm Computer Aided Drug Design Unit 3 PDF Notes! Buckle up as we explore powerful computational tools to find promising drug candidates without the lab. Imagine filtering vast libraries of molecules, predicting their "drug-likeness", and identifying those with the right properties. We'll delve into the concept of pharmacophore mapping, understanding the essential functional groups a drug needs to interact with its target. Feeling hands-on? Master docking techniques, simulating how a drug fits into a target protein like a lock and key. Explore both rigid and flexible docking methods, considering the dynamic nature of molecules. But it's not just screening existing molecules; imagine designing drugs from scratch with de novo drug design. By the end of this unit, you'll be a virtual drug discovery whiz, equipped to explore countless possibilities and accelerate the development of life-saving medications!


B Pharm Computer Aided Drug Design Notes
B Pharm Computer Aided Drug Design Notes

B Pharm Computer Aided Drug Design Unit 3 PDF Notes


Unit 3


Molecular Modeling and virtual screening techniques


Virtual Screening techniques: Drug likeness screening, Concept of pharmacophore mapping and pharmacophore based Screening


Molecular docking: Rigid docking, flexible docking, manual docking, Docking based screening. De novo drug design.


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